(4-methylcyclohexyl) 7-methoxy-5-[3-[(6-methyl-6-oxidanyl-heptan-2-yl)amino]-3-oxidanylidene-propyl]-2-phenyl-1-benzofuran-3-carboxylate

Systemtic Name: (4-methylcyclohexyl) 7-methoxy-5-[3-[(6-methyl-6-oxidanyl-heptan-2-yl)amino]-3-oxidanylidene-propyl]-2-phenyl-1-benzofuran-3-carboxylate Openeye Name: (4-methylcyclohexyl) 5-[3-[(5-hydroxy-1,5-dimethyl-hexyl)amino]-3-oxo-propyl]-7-methoxy-2-phenyl-benzofuran-3-carboxylate CAS Name: 5-[3-[(6-hydroxy-6-methylheptan-2-yl)amino]-3-oxopropyl]-7-methoxy-2-phenyl-3-benzofurancarboxylic acid (4-methylcyclohexyl) ester IUPAC Name: (4-methylcyclohexyl) 5-[3-[(6-hydroxy-6-methylheptan-2-yl)amino]-3-oxopropyl]-7-methoxy-2-phenyl-1-benzofuran-3-carboxylate Traditional Name: 5-[3-[(5-hydroxy-1,5-dimethyl-hexyl)amino]-3-keto-propyl]-7-methoxy-2-phenyl-benzofuran-3-carboxylic acid (4-methylcyclohexyl) ester Formula: C34H45NO6 MolecularWeight: 563.7242

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(CC1)OC(=O)C2=C(OC3=C(C=C(C=C23)CCC(=O)NC(C)CCCC(C)(C)O)OC)C4=CC=CC=C4

Isomeric SMILES

CC1CCC(CC1)OC(=O)C2=C(OC3=C(C=C(C=C23)CCC(=O)NC(C)CCCC(C)(C)O)OC)C4=CC=CC=C4

InChI

InChI=1S/C34H45NO6/c1-22-13-16-26(17-14-22)40-33(37)30-27-20-24(15-18-29(36)35-23(2)10-9-19-34(3,4)38)21-28(39-5)32(27)41-31(30)25-11-7-6-8-12-25/h6-8,11-12,20-23,26,38H,9-10,13-19H2,1-5H3,(H,35,36)