Name: Name:tert-butyl 7-acetamido-1,2,3,4-tetrahydroisoquinoline-2-carboxylate
Brand: Angene
SKU: AG019ZN6
Rating: 90 (10 reviews)

tert-butyl 7-acetamido-1,2,3,4-tetrahydroisoquinoline-2-carboxylate

CAS No.:

1384672-04-1

Catalog Number:

AG019ZN6

Molecular Formula:

C16H22N2O3

Molecular Weight:

290.3575

Catalog Number:

AG019ZN6

Chemical Name:

tert-butyl 7-acetamido-1,2,3,4-tetrahydroisoquinoline-2-carboxylate

CAS Number:

1384672-04-1

Molecular Formula:

C16H22N2O3

Molecular Weight:

290.3575

MDL Number:

MFCD22375254

IUPAC Name:

tert-butyl 7-acetamido-3,4-dihydro-1H-isoquinoline-2-carboxylate

InChI:

InChI=1S/C16H22N2O3/c1-11(19)17-14-6-5-12-7-8-18(10-13(12)9-14)15(20)21-16(2,3)4/h5-6,9H,7-8,10H2,1-4H3,(H,17,19)

InChI Key:

CQEZDCYIWMTLBZ-UHFFFAOYSA-N

SMILES:

CC(=O)Nc1ccc2c(c1)CN(CC2)C(=O)OC(C)(C)C

Complexity:

403

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

290.163g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

290.363g/mol

Monoisotopic Mass:

290.163g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

58.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.8