5-[(5-cyclohexyl-2-oxidanylidene-3-pentanoyl-imidazol-1-yl)methyl]-2-phenyl-benzoic acid

Systemtic Name: 5-[(5-cyclohexyl-2-oxidanylidene-3-pentanoyl-imidazol-1-yl)methyl]-2-phenyl-benzoic acid Openeye Name: 5-[(5-cyclohexyl-2-oxo-3-pentanoyl-imidazol-1-yl)methyl]-2-phenyl-benzoic acid CAS Name: 5-[[5-cyclohexyl-2-oxo-3-(1-oxopentyl)-1-imidazolyl]methyl]-2-phenylbenzoic acid IUPAC Name: 5-[(5-cyclohexyl-2-oxo-3-pentanoylimidazol-1-yl)methyl]-2-phenylbenzoic acid Traditional Name: 5-[(5-cyclohexyl-2-keto-3-valeryl-4-imidazolin-1-yl)methyl]-2-phenyl-benzoic acid Formula: C28H32N2O4 MolecularWeight: 460.56468

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)N1C=C(N(C1=O)CC2=CC(=C(C=C2)C3=CC=CC=C3)C(=O)O)C4CCCCC4

Isomeric SMILES

CCCCC(=O)N1C=C(N(C1=O)CC2=CC(=C(C=C2)C3=CC=CC=C3)C(=O)O)C4CCCCC4

InChI

InChI=1S/C28H32N2O4/c1-2-3-14-26(31)30-19-25(22-12-8-5-9-13-22)29(28(30)34)18-20-15-16-23(24(17-20)27(32)33)21-10-6-4-7-11-21/h4,6-7,10-11,15-17,19,22H,2-3,5,8-9,12-14,18H2,1H3,(H,32,33)