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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H27NO6/c1-20-9-12-23(13-10-20)34-17-5-8-27(31)35-24-14-11-22-18-25(29(33)36-26(22)19-24)28(32)30-16-15-21-6-3-2-4-7-21/h2-4,6-7,9-14,18-19H,5,8,15-17H2,1H3,(H,30,32)