(7-acetamido-2-oxidanylidene-chromen-4-yl)methyl 2-[(4-methylphenyl)carbonylamino]ethanoate

Systemtic Name: (7-acetamido-2-oxidanylidene-chromen-4-yl)methyl 2-[(4-methylphenyl)carbonylamino]ethanoate Openeye Name: (7-acetamido-2-oxo-chromen-4-yl)methyl 2-[(4-methylbenzoyl)amino]acetate CAS Name: 2-[[(4-methylphenyl)-oxomethyl]amino]acetic acid (7-acetamido-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-acetamido-2-oxochromen-4-yl)methyl 2-[(4-methylbenzoyl)amino]acetate Traditional Name: 2-(p-toluoylamino)acetic acid (7-acetamido-2-keto-chromen-4-yl)methyl ester Formula: C22H20N2O6 MolecularWeight: 408.404

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NCC(=O)OCC2=CC(=O)OC3=C2C=CC(=C3)NC(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)NCC(=O)OCC2=CC(=O)OC3=C2C=CC(=C3)NC(=O)C

InChI

InChI=1S/C22H20N2O6/c1-13-3-5-15(6-4-13)22(28)23-11-21(27)29-12-16-9-20(26)30-19-10-17(24-14(2)25)7-8-18(16)19/h3-10H,11-12H2,1-2H3,(H,23,28)(H,24,25)