[2-oxidanylidene-3-[(phenylmethyl)carbamoyl]chromen-7-yl] 4-(4-tert-butylphenoxy)butanoate

Systemtic Name: [2-oxidanylidene-3-[(phenylmethyl)carbamoyl]chromen-7-yl] 4-(4-tert-butylphenoxy)butanoate Openeye Name: [3-(benzylcarbamoyl)-2-oxo-chromen-7-yl] 4-(4-tert-butylphenoxy)butanoate CAS Name: 4-(4-tert-butylphenoxy)butanoic acid [2-oxo-3-[oxo-[(phenylmethyl)amino]methyl]-1-benzopyran-7-yl] ester IUPAC Name: [3-(benzylcarbamoyl)-2-oxochromen-7-yl] 4-(4-tert-butylphenoxy)butanoate Traditional Name: 4-(4-tert-butylphenoxy)butyric acid [3-(benzylcarbamoyl)-2-keto-chromen-7-yl] ester Formula: C31H31NO6 MolecularWeight: 513.58094

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C31H31NO6/c1-31(2,3)23-12-15-24(16-13-23)36-17-7-10-28(33)37-25-14-11-22-18-26(30(35)38-27(22)19-25)29(34)32-20-21-8-5-4-6-9-21/h4-6,8-9,11-16,18-19H,7,10,17,20H2,1-3H3,(H,32,34)