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

Systemtic Name: [2-oxidanylidene-3-(phenethylcarbamoyl)chromen-7-yl] 3,4-dimethylbenzoate Openeye Name: [2-oxo-3-(phenethylcarbamoyl)chromen-7-yl] 3,4-dimethylbenzoate CAS Name: 3,4-dimethylbenzoic acid [2-oxo-3-[oxo-(phenethylamino)methyl]-1-benzopyran-7-yl] ester IUPAC Name: [2-oxo-3-(phenethylcarbamoyl)chromen-7-yl] 3,4-dimethylbenzoate Traditional Name: 3,4-dimethylbenzoic acid [2-keto-3-(phenethylcarbamoyl)chromen-7-yl] ester Formula: C27H23NO5 MolecularWeight: 441.47522

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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)NCCC4=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)NCCC4=CC=CC=C4)C

InChI

InChI=1S/C27H23NO5/c1-17-8-9-21(14-18(17)2)26(30)32-22-11-10-20-15-23(27(31)33-24(20)16-22)25(29)28-13-12-19-6-4-3-5-7-19/h3-11,14-16H,12-13H2,1-2H3,(H,28,29)