2-[2-[[3,3-dimethyl-1-oxidanyl-4-(4-phenylphenyl)butan-2-yl]amino]-2-oxidanylidene-1-pyrrol-1-yl-ethyl]-5-oxidanyl-pentanoic acid

Systemtic Name: 2-[2-[[3,3-dimethyl-1-oxidanyl-4-(4-phenylphenyl)butan-2-yl]amino]-2-oxidanylidene-1-pyrrol-1-yl-ethyl]-5-oxidanyl-pentanoic acid Openeye Name: 5-hydroxy-2-[2-[[1-(hydroxymethyl)-2,2-dimethyl-3-(4-phenylphenyl)propyl]amino]-2-oxo-1-pyrrol-1-yl-ethyl]pentanoic acid CAS Name: 5-hydroxy-2-[2-[[1-hydroxy-3,3-dimethyl-4-(4-phenylphenyl)butan-2-yl]amino]-2-oxo-1-(1-pyrrolyl)ethyl]pentanoic acid IUPAC Name: 5-hydroxy-2-[2-[[1-hydroxy-3,3-dimethyl-4-(4-phenylphenyl)butan-2-yl]amino]-2-oxo-1-pyrrol-1-ylethyl]pentanoic acid Traditional Name: 2-[2-[[2,2-dimethyl-1-methylol-3-(4-phenylphenyl)propyl]amino]-2-keto-1-pyrrol-1-yl-ethyl]-5-hydroxy-valeric acid Formula: C29H36N2O5 MolecularWeight: 492.60654

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CC1=CC=C(C=C1)C2=CC=CC=C2)C(CO)NC(=O)C(C(CCCO)C(=O)O)N3C=CC=C3

Isomeric SMILES

CC(C)(CC1=CC=C(C=C1)C2=CC=CC=C2)C(CO)NC(=O)C(C(CCCO)C(=O)O)N3C=CC=C3

InChI

InChI=1S/C29H36N2O5/c1-29(2,19-21-12-14-23(15-13-21)22-9-4-3-5-10-22)25(20-33)30-27(34)26(31-16-6-7-17-31)24(28(35)36)11-8-18-32/h3-7,9-10,12-17,24-26,32-33H,8,11,18-20H2,1-2H3,(H,30,34)(H,35,36)