3-indol-1-yloxycarbonyl-2-methyl-3-[[4-(2-methylpropyl)phenyl]methylamino]-4-oxidanylidene-4-phenyl-butanoic acid

Systemtic Name: 3-indol-1-yloxycarbonyl-2-methyl-3-[[4-(2-methylpropyl)phenyl]methylamino]-4-oxidanylidene-4-phenyl-butanoic acid Openeye Name: 3-benzoyl-4-indol-1-yloxy-3-[(4-isobutylphenyl)methylamino]-2-methyl-4-oxo-butanoic acid CAS Name: 3-benzoyl-4-(1-indolyloxy)-2-methyl-3-[[4-(2-methylpropyl)phenyl]methylamino]-4-oxobutanoic acid IUPAC Name: 3-benzoyl-4-indol-1-yloxy-2-methyl-3-[[4-(2-methylpropyl)phenyl]methylamino]-4-oxobutanoic acid Traditional Name: 3-benzoyl-4-indol-1-yloxy-3-[(4-isobutylbenzyl)amino]-4-keto-2-methyl-butyric acid Formula: C31H32N2O5 MolecularWeight: 512.59618

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=CC=C(C=C1)CNC(C(C)C(=O)O)(C(=O)C2=CC=CC=C2)C(=O)ON3C=CC4=CC=CC=C43

Isomeric SMILES

CC(C)CC1=CC=C(C=C1)CNC(C(C)C(=O)O)(C(=O)C2=CC=CC=C2)C(=O)ON3C=CC4=CC=CC=C43

InChI

InChI=1S/C31H32N2O5/c1-21(2)19-23-13-15-24(16-14-23)20-32-31(22(3)29(35)36,28(34)26-10-5-4-6-11-26)30(37)38-33-18-17-25-9-7-8-12-27(25)33/h4-18,21-22,32H,19-20H2,1-3H3,(H,35,36)