Name: Name:Benzoic acid, 4-[[(2,2-dimethyl-4,6-dioxo-1,3-dioxan-5-ylidene)methyl]amino]-2-methoxy-, methyl ester
Brand: Angene
SKU: AG002A2V
Rating: 90 (10 reviews)

Benzoic acid, 4-[[(2,2-dimethyl-4,6-dioxo-1,3-dioxan-5-ylidene)methyl]amino]-2-methoxy-, methyl ester

CAS No.:

205448-64-2

Catalog Number:

AG002A2V

Molecular Formula:

C16H17NO7

Molecular Weight:

335.3087

Catalog Number:

AG002A2V

Chemical Name:

Benzoic acid, 4-[[(2,2-dimethyl-4,6-dioxo-1,3-dioxan-5-ylidene)methyl]amino]-2-methoxy-, methyl ester

CAS Number:

205448-64-2

Molecular Formula:

C16H17NO7

Molecular Weight:

335.3087

MDL Number:

MFCD26395147

IUPAC Name:

methyl 4-[(2,2-dimethyl-4,6-dioxo-1,3-dioxan-5-ylidene)methylamino]-2-methoxybenzoate

InChI:

InChI=1S/C16H17NO7/c1-16(2)23-14(19)11(15(20)24-16)8-17-9-5-6-10(13(18)22-4)12(7-9)21-3/h5-8,17H,1-4H3

InChI Key:

FLQIWMCFHBVQGR-UHFFFAOYSA-N

SMILES:

COC(=O)c1ccc(cc1OC)NC=C1C(=O)OC(OC1=O)(C)C

Complexity:

533

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

335.101g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

335.312g/mol

Monoisotopic Mass:

335.101g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

100A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.3