1-(3-imidazol-1-ylpropyl)-3-[(7-methoxy-1-benzofuran-2-yl)carbonyl]-2-[3-(3-methylbutoxy)phenyl]-4-oxidanyl-2H-pyrrol-5-one

Systemtic Name: 1-(3-imidazol-1-ylpropyl)-3-[(7-methoxy-1-benzofuran-2-yl)carbonyl]-2-[3-(3-methylbutoxy)phenyl]-4-oxidanyl-2H-pyrrol-5-one Openeye Name: 4-hydroxy-1-(3-imidazol-1-ylpropyl)-2-(3-isopentyloxyphenyl)-3-(7-methoxybenzofuran-2-carbonyl)-2H-pyrrol-5-one CAS Name: 4-hydroxy-1-[3-(1-imidazolyl)propyl]-3-[(7-methoxy-2-benzofuranyl)-oxomethyl]-2-[3-(3-methylbutoxy)phenyl]-2H-pyrrol-5-one IUPAC Name: 4-hydroxy-1-(3-imidazol-1-ylpropyl)-3-(7-methoxy-1-benzofuran-2-carbonyl)-2-[3-(3-methylbutoxy)phenyl]-2H-pyrrol-5-one Traditional Name: 3-hydroxy-1-(3-imidazol-1-ylpropyl)-5-(3-isoamoxyphenyl)-4-(7-methoxybenzofuran-2-carbonyl)-3-pyrrolin-2-one Formula: C31H33N3O6 MolecularWeight: 543.61022

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC1=CC=CC(=C1)C2C(=C(C(=O)N2CCCN3C=CN=C3)O)C(=O)C4=CC5=C(O4)C(=CC=C5)OC

Isomeric SMILES

CC(C)CCOC1=CC=CC(=C1)C2C(=C(C(=O)N2CCCN3C=CN=C3)O)C(=O)C4=CC5=C(O4)C(=CC=C5)OC

InChI

InChI=1S/C31H33N3O6/c1-20(2)11-16-39-23-9-4-7-21(17-23)27-26(28(35)25-18-22-8-5-10-24(38-3)30(22)40-25)29(36)31(37)34(27)14-6-13-33-15-12-32-19-33/h4-5,7-10,12,15,17-20,27,36H,6,11,13-14,16H2,1-3H3