(7-bromanyl-2-oxidanylidene-chromen-4-yl)methyl 2-[(3,4-dimethoxyphenyl)carbonylamino]ethanoate

Systemtic Name: (7-bromanyl-2-oxidanylidene-chromen-4-yl)methyl 2-[(3,4-dimethoxyphenyl)carbonylamino]ethanoate Openeye Name: (7-bromo-2-oxo-chromen-4-yl)methyl 2-[(3,4-dimethoxybenzoyl)amino]acetate CAS Name: 2-[[(3,4-dimethoxyphenyl)-oxomethyl]amino]acetic acid (7-bromo-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-bromo-2-oxochromen-4-yl)methyl 2-[(3,4-dimethoxybenzoyl)amino]acetate Traditional Name: 2-(veratroylamino)acetic acid (7-bromo-2-keto-chromen-4-yl)methyl ester Formula: C21H18BrNO7 MolecularWeight: 476.27412

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NCC(=O)OCC2=CC(=O)OC3=C2C=CC(=C3)Br)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NCC(=O)OCC2=CC(=O)OC3=C2C=CC(=C3)Br)OC

InChI

InChI=1S/C21H18BrNO7/c1-27-16-6-3-12(7-18(16)28-2)21(26)23-10-20(25)29-11-13-8-19(24)30-17-9-14(22)4-5-15(13)17/h3-9H,10-11H2,1-2H3,(H,23,26)