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

Systemtic Name: 2-indol-1-yl-3-methyl-3-[[4-(2-methylpropyl)phenyl]methylamino]-4-oxidanylidene-2-(phenylcarbonyl)-4-phenylmethoxy-butanoic acid Openeye Name: 2-benzoyl-4-benzyloxy-2-indol-1-yl-3-[(4-isobutylphenyl)methylamino]-3-methyl-4-oxo-butanoic acid CAS Name: 2-benzoyl-2-(1-indolyl)-3-methyl-3-[[4-(2-methylpropyl)phenyl]methylamino]-4-oxo-4-phenylmethoxybutanoic acid IUPAC Name: 2-benzoyl-2-indol-1-yl-3-methyl-3-[[4-(2-methylpropyl)phenyl]methylamino]-4-oxo-4-phenylmethoxybutanoic acid Traditional Name: 4-benzoxy-2-benzoyl-2-indol-1-yl-3-[(4-isobutylbenzyl)amino]-4-keto-3-methyl-butyric acid Formula: C38H38N2O5 MolecularWeight: 602.71872

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=CC=C(C=C1)CNC(C)(C(=O)OCC2=CC=CC=C2)C(C(=O)C3=CC=CC=C3)(C(=O)O)N4C=CC5=CC=CC=C54

Isomeric SMILES

CC(C)CC1=CC=C(C=C1)CNC(C)(C(=O)OCC2=CC=CC=C2)C(C(=O)C3=CC=CC=C3)(C(=O)O)N4C=CC5=CC=CC=C54

InChI

InChI=1S/C38H38N2O5/c1-27(2)24-28-18-20-29(21-19-28)25-39-37(3,36(44)45-26-30-12-6-4-7-13-30)38(35(42)43,34(41)32-15-8-5-9-16-32)40-23-22-31-14-10-11-17-33(31)40/h4-23,27,39H,24-26H2,1-3H3,(H,42,43)