[2-oxidanylidene-3-[(phenylmethyl)carbamoyl]chromen-7-yl] 3,4-dimethylbenzoate

Systemtic Name: [2-oxidanylidene-3-[(phenylmethyl)carbamoyl]chromen-7-yl] 3,4-dimethylbenzoate Openeye Name: [3-(benzylcarbamoyl)-2-oxo-chromen-7-yl] 3,4-dimethylbenzoate CAS Name: 3,4-dimethylbenzoic acid [2-oxo-3-[oxo-[(phenylmethyl)amino]methyl]-1-benzopyran-7-yl] ester IUPAC Name: [3-(benzylcarbamoyl)-2-oxochromen-7-yl] 3,4-dimethylbenzoate Traditional Name: 3,4-dimethylbenzoic acid [3-(benzylcarbamoyl)-2-keto-chromen-7-yl] ester Formula: C26H21NO5 MolecularWeight: 427.44864

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC2=CC3=C(C=C2)C=C(C(=O)O3)C(=O)NCC4=CC=CC=C4)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC2=CC3=C(C=C2)C=C(C(=O)O3)C(=O)NCC4=CC=CC=C4)C

InChI

InChI=1S/C26H21NO5/c1-16-8-9-20(12-17(16)2)25(29)31-21-11-10-19-13-22(26(30)32-23(19)14-21)24(28)27-15-18-6-4-3-5-7-18/h3-14H,15H2,1-2H3,(H,27,28)