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

Systemtic Name: 2-[4-[(5-butyl-3-cyclohexylcarbonyl-4-methanoyl-2-oxidanylidene-imidazol-1-yl)methyl]phenyl]benzoic acid Openeye Name: 2-[4-[[5-butyl-3-(cyclohexanecarbonyl)-4-formyl-2-oxo-imidazol-1-yl]methyl]phenyl]benzoic acid CAS Name: 2-[4-[[5-butyl-3-[cyclohexyl(oxo)methyl]-4-formyl-2-oxo-1-imidazolyl]methyl]phenyl]benzoic acid IUPAC Name: 2-[4-[[5-butyl-3-(cyclohexanecarbonyl)-4-formyl-2-oxoimidazol-1-yl]methyl]phenyl]benzoic acid Traditional Name: 2-[4-[[5-butyl-3-(cyclohexanecarbonyl)-4-formyl-2-keto-4-imidazolin-1-yl]methyl]phenyl]benzoic acid Formula: C29H32N2O5 MolecularWeight: 488.57478

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(N(C(=O)N1CC2=CC=C(C=C2)C3=CC=CC=C3C(=O)O)C(=O)C4CCCCC4)C=O

Isomeric SMILES

CCCCC1=C(N(C(=O)N1CC2=CC=C(C=C2)C3=CC=CC=C3C(=O)O)C(=O)C4CCCCC4)C=O

InChI

InChI=1S/C29H32N2O5/c1-2-3-13-25-26(19-32)31(27(33)22-9-5-4-6-10-22)29(36)30(25)18-20-14-16-21(17-15-20)23-11-7-8-12-24(23)28(34)35/h7-8,11-12,14-17,19,22H,2-6,9-10,13,18H2,1H3,(H,34,35)