[2-oxidanylidene-3-(1-phenylethylcarbamoyl)chromen-7-yl] 4-(3-methylphenoxy)butanoate

Systemtic Name: [2-oxidanylidene-3-(1-phenylethylcarbamoyl)chromen-7-yl] 4-(3-methylphenoxy)butanoate Openeye Name: [2-oxo-3-(1-phenylethylcarbamoyl)chromen-7-yl] 4-(3-methylphenoxy)butanoate CAS Name: 4-(3-methylphenoxy)butanoic acid [2-oxo-3-[oxo-(1-phenylethylamino)methyl]-1-benzopyran-7-yl] ester IUPAC Name: [2-oxo-3-(1-phenylethylcarbamoyl)chromen-7-yl] 4-(3-methylphenoxy)butanoate Traditional Name: 4-(3-methylphenoxy)butyric acid [2-keto-3-(1-phenylethylcarbamoyl)chromen-7-yl] ester Formula: C29H27NO6 MolecularWeight: 485.52778

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H27NO6/c1-19-8-6-11-23(16-19)34-15-7-12-27(31)35-24-14-13-22-17-25(29(33)36-26(22)18-24)28(32)30-20(2)21-9-4-3-5-10-21/h3-6,8-11,13-14,16-18,20H,7,12,15H2,1-2H3,(H,30,32)