2-[(3-cyclohexylcarbonyl-4-methanoyl-2-oxidanylidene-5-propyl-imidazol-1-yl)methyl]-6-phenyl-benzoic acid

Systemtic Name: 2-[(3-cyclohexylcarbonyl-4-methanoyl-2-oxidanylidene-5-propyl-imidazol-1-yl)methyl]-6-phenyl-benzoic acid Openeye Name: 2-[[3-(cyclohexanecarbonyl)-4-formyl-2-oxo-5-propyl-imidazol-1-yl]methyl]-6-phenyl-benzoic acid CAS Name: 2-[[3-[cyclohexyl(oxo)methyl]-4-formyl-2-oxo-5-propyl-1-imidazolyl]methyl]-6-phenylbenzoic acid IUPAC Name: 2-[[3-(cyclohexanecarbonyl)-4-formyl-2-oxo-5-propylimidazol-1-yl]methyl]-6-phenylbenzoic acid Traditional Name: 2-[[3-(cyclohexanecarbonyl)-4-formyl-2-keto-5-propyl-4-imidazolin-1-yl]methyl]-6-phenyl-benzoic acid Formula: C28H30N2O5 MolecularWeight: 474.5482

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(N(C(=O)N1CC2=CC=CC(=C2C(=O)O)C3=CC=CC=C3)C(=O)C4CCCCC4)C=O

Isomeric SMILES

CCCC1=C(N(C(=O)N1CC2=CC=CC(=C2C(=O)O)C3=CC=CC=C3)C(=O)C4CCCCC4)C=O

InChI

InChI=1S/C28H30N2O5/c1-2-10-23-24(18-31)30(26(32)20-13-7-4-8-14-20)28(35)29(23)17-21-15-9-16-22(25(21)27(33)34)19-11-5-3-6-12-19/h3,5-6,9,11-12,15-16,18,20H,2,4,7-8,10,13-14,17H2,1H3,(H,33,34)