Name: Name:7-chloro-2-{[(9H-fluoren-9-yl)methoxy]carbonyl}-1,2,3,4-tetrahydroisoquinoline-4-carboxylic acid
Brand: Angene
SKU: AG01EKOM
Rating: 90 (10 reviews)

7-chloro-2-{[(9H-fluoren-9-yl)methoxy]carbonyl}-1,2,3,4-tetrahydroisoquinoline-4-carboxylic acid

CAS No.:

2138132-33-7

Catalog Number:

AG01EKOM

Molecular Formula:

C25H20ClNO4

Molecular Weight:

433.8836

Catalog Number:

AG01EKOM

Chemical Name:

7-chloro-2-{[(9H-fluoren-9-yl)methoxy]carbonyl}-1,2,3,4-tetrahydroisoquinoline-4-carboxylic acid

CAS Number:

2138132-33-7

Molecular Formula:

C25H20ClNO4

Molecular Weight:

433.8836

MDL Number:

MFCD31615472

IUPAC Name:

7-chloro-2-(9H-fluoren-9-ylmethoxycarbonyl)-3,4-dihydro-1H-isoquinoline-4-carboxylic acid

InChI:

InChI=1S/C25H20ClNO4/c26-16-9-10-17-15(11-16)12-27(13-22(17)24(28)29)25(30)31-14-23-20-7-3-1-5-18(20)19-6-2-4-8-21(19)23/h1-11,22-23H,12-14H2,(H,28,29)

InChI Key:

GLEXAOWFGNDPOG-UHFFFAOYSA-N

SMILES:

Clc1ccc2c(c1)CN(CC2C(=O)O)C(=O)OCC1c2ccccc2c2c1cccc2

Complexity:

664

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

433.108g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

433.888g/mol

Monoisotopic Mass:

433.108g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

66.8A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

4.6