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

Systemtic Name: (7,8-dimethyl-2-oxidanylidene-chromen-4-yl)methyl 2-[(3-methylphenyl)carbonylamino]ethanoate Openeye Name: (7,8-dimethyl-2-oxo-chromen-4-yl)methyl 2-[(3-methylbenzoyl)amino]acetate CAS Name: 2-[[(3-methylphenyl)-oxomethyl]amino]acetic acid (7,8-dimethyl-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7,8-dimethyl-2-oxochromen-4-yl)methyl 2-[(3-methylbenzoyl)amino]acetate Traditional Name: 2-(m-toluoylamino)acetic acid (2-keto-7,8-dimethyl-chromen-4-yl)methyl ester Formula: C22H21NO5 MolecularWeight: 379.40584

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)C(=CC(=O)O2)COC(=O)CNC(=O)C3=CC(=CC=C3)C)C

Isomeric SMILES

CC1=C(C2=C(C=C1)C(=CC(=O)O2)COC(=O)CNC(=O)C3=CC(=CC=C3)C)C

InChI

InChI=1S/C22H21NO5/c1-13-5-4-6-16(9-13)22(26)23-11-20(25)27-12-17-10-19(24)28-21-15(3)14(2)7-8-18(17)21/h4-10H,11-12H2,1-3H3,(H,23,26)