[2-oxidanylidene-3-(phenethylcarbamoyl)chromen-7-yl] 2,4,6-trimethylbenzoate

Systemtic Name: [2-oxidanylidene-3-(phenethylcarbamoyl)chromen-7-yl] 2,4,6-trimethylbenzoate Openeye Name: [2-oxo-3-(phenethylcarbamoyl)chromen-7-yl] 2,4,6-trimethylbenzoate CAS Name: 2,4,6-trimethylbenzoic acid [2-oxo-3-[oxo-(phenethylamino)methyl]-1-benzopyran-7-yl] ester IUPAC Name: [2-oxo-3-(phenethylcarbamoyl)chromen-7-yl] 2,4,6-trimethylbenzoate Traditional Name: 2,4,6-trimethylbenzoic acid [2-keto-3-(phenethylcarbamoyl)chromen-7-yl] ester Formula: C28H25NO5 MolecularWeight: 455.5018

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)C(=O)OC2=CC3=C(C=C2)C=C(C(=O)O3)C(=O)NCCC4=CC=CC=C4)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)C(=O)OC2=CC3=C(C=C2)C=C(C(=O)O3)C(=O)NCCC4=CC=CC=C4)C

InChI

InChI=1S/C28H25NO5/c1-17-13-18(2)25(19(3)14-17)28(32)33-22-10-9-21-15-23(27(31)34-24(21)16-22)26(30)29-12-11-20-7-5-4-6-8-20/h4-10,13-16H,11-12H2,1-3H3,(H,29,30)