3-azanyl-3-ethyl-2-indolizin-3-yl-5-[[4-(2-methylpropyl)phenyl]amino]-5-oxidanylidene-2-(phenylcarbonyl)pentanoic acid

Systemtic Name: 3-azanyl-3-ethyl-2-indolizin-3-yl-5-[[4-(2-methylpropyl)phenyl]amino]-5-oxidanylidene-2-(phenylcarbonyl)pentanoic acid Openeye Name: 3-amino-2-benzoyl-3-ethyl-2-indolizin-3-yl-5-(4-isobutylanilino)-5-oxo-pentanoic acid CAS Name: 3-amino-2-benzoyl-3-ethyl-2-(3-indolizinyl)-5-[4-(2-methylpropyl)anilino]-5-oxopentanoic acid IUPAC Name: 3-amino-2-benzoyl-3-ethyl-2-indolizin-3-yl-5-[4-(2-methylpropyl)anilino]-5-oxopentanoic acid Traditional Name: 3-amino-2-benzoyl-3-ethyl-2-indolizin-3-yl-5-(4-isobutylanilino)-5-keto-valeric acid Formula: C32H35N3O4 MolecularWeight: 525.638

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC(=O)NC1=CC=C(C=C1)CC(C)C)(C(C2=CC=C3N2C=CC=C3)(C(=O)C4=CC=CC=C4)C(=O)O)N

Isomeric SMILES

CCC(CC(=O)NC1=CC=C(C=C1)CC(C)C)(C(C2=CC=C3N2C=CC=C3)(C(=O)C4=CC=CC=C4)C(=O)O)N

InChI

InChI=1S/C32H35N3O4/c1-4-31(33,21-28(36)34-25-15-13-23(14-16-25)20-22(2)3)32(30(38)39,29(37)24-10-6-5-7-11-24)27-18-17-26-12-8-9-19-35(26)27/h5-19,22H,4,20-21,33H2,1-3H3,(H,34,36)(H,38,39)