[2-oxidanylidene-3-[(phenylmethyl)carbamoyl]chromen-7-yl] (E)-3-(4-methylphenyl)prop-2-enoate

Systemtic Name: [2-oxidanylidene-3-[(phenylmethyl)carbamoyl]chromen-7-yl] (E)-3-(4-methylphenyl)prop-2-enoate Openeye Name: [3-(benzylcarbamoyl)-2-oxo-chromen-7-yl] (E)-3-(p-tolyl)prop-2-enoate CAS Name: (E)-3-(4-methylphenyl)-2-propenoic acid [2-oxo-3-[oxo-[(phenylmethyl)amino]methyl]-1-benzopyran-7-yl] ester IUPAC Name: [3-(benzylcarbamoyl)-2-oxochromen-7-yl] (E)-3-(4-methylphenyl)prop-2-enoate Traditional Name: (E)-3-(p-tolyl)acrylic acid [3-(benzylcarbamoyl)-2-keto-chromen-7-yl] ester Formula: C27H21NO5 MolecularWeight: 439.45934

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H21NO5/c1-18-7-9-19(10-8-18)11-14-25(29)32-22-13-12-21-15-23(27(31)33-24(21)16-22)26(30)28-17-20-5-3-2-4-6-20/h2-16H,17H2,1H3,(H,28,30)/b14-11+