2-[(1-cyclohexyl-2-pyridin-2-yl-benzimidazol-5-yl)carbonylamino]-3-(4-hydroxyphenyl)-2-methyl-propanoic acid

Systemtic Name: 2-[(1-cyclohexyl-2-pyridin-2-yl-benzimidazol-5-yl)carbonylamino]-3-(4-hydroxyphenyl)-2-methyl-propanoic acid Openeye Name: 2-[[1-cyclohexyl-2-(2-pyridyl)benzimidazole-5-carbonyl]amino]-3-(4-hydroxyphenyl)-2-methyl-propanoic acid CAS Name: 2-[[[1-cyclohexyl-2-(2-pyridinyl)-5-benzimidazolyl]-oxomethyl]amino]-3-(4-hydroxyphenyl)-2-methylpropanoic acid IUPAC Name: 2-[(1-cyclohexyl-2-pyridin-2-ylbenzimidazole-5-carbonyl)amino]-3-(4-hydroxyphenyl)-2-methylpropanoic acid Traditional Name: 2-[[1-cyclohexyl-2-(2-pyridyl)benzimidazole-5-carbonyl]amino]-3-(4-hydroxyphenyl)-2-methyl-propionic acid Formula: C29H30N4O4 MolecularWeight: 498.5729

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CC=C(C=C1)O)(C(=O)O)NC(=O)C2=CC3=C(C=C2)N(C(=N3)C4=CC=CC=N4)C5CCCCC5

Isomeric SMILES

CC(CC1=CC=C(C=C1)O)(C(=O)O)NC(=O)C2=CC3=C(C=C2)N(C(=N3)C4=CC=CC=N4)C5CCCCC5

InChI

InChI=1S/C29H30N4O4/c1-29(28(36)37,18-19-10-13-22(34)14-11-19)32-27(35)20-12-15-25-24(17-20)31-26(23-9-5-6-16-30-23)33(25)21-7-3-2-4-8-21/h5-6,9-17,21,34H,2-4,7-8,18H2,1H3,(H,32,35)(H,36,37)