(8-methyl-7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl 2-[(3-methylphenyl)carbonylamino]ethanoate

Systemtic Name: (8-methyl-7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl 2-[(3-methylphenyl)carbonylamino]ethanoate Openeye Name: (7-hydroxy-8-methyl-2-oxo-chromen-4-yl)methyl 2-[(3-methylbenzoyl)amino]acetate CAS Name: 2-[[(3-methylphenyl)-oxomethyl]amino]acetic acid (7-hydroxy-8-methyl-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-hydroxy-8-methyl-2-oxochromen-4-yl)methyl 2-[(3-methylbenzoyl)amino]acetate Traditional Name: 2-(m-toluoylamino)acetic acid (7-hydroxy-2-keto-8-methyl-chromen-4-yl)methyl ester Formula: C21H19NO6 MolecularWeight: 381.37866

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)NCC(=O)OCC2=CC(=O)OC3=C2C=CC(=C3C)O

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)NCC(=O)OCC2=CC(=O)OC3=C2C=CC(=C3C)O

InChI

InChI=1S/C21H19NO6/c1-12-4-3-5-14(8-12)21(26)22-10-19(25)27-11-15-9-18(24)28-20-13(2)17(23)7-6-16(15)20/h3-9,23H,10-11H2,1-2H3,(H,22,26)