2-[(5-butan-2-yl-3-ethyl-2-oxidanylidene-imidazol-1-yl)methyl]-6-phenyl-benzoic acid

Systemtic Name: 2-[(5-butan-2-yl-3-ethyl-2-oxidanylidene-imidazol-1-yl)methyl]-6-phenyl-benzoic acid Openeye Name: 2-[(3-ethyl-2-oxo-5-sec-butyl-imidazol-1-yl)methyl]-6-phenyl-benzoic acid CAS Name: 2-[(5-butan-2-yl-3-ethyl-2-oxo-1-imidazolyl)methyl]-6-phenylbenzoic acid IUPAC Name: 2-[(5-butan-2-yl-3-ethyl-2-oxoimidazol-1-yl)methyl]-6-phenylbenzoic acid Traditional Name: 2-[(3-ethyl-2-keto-5-sec-butyl-4-imidazolin-1-yl)methyl]-6-phenyl-benzoic acid Formula: C23H26N2O3 MolecularWeight: 378.46414

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CN(C(=O)N1CC2=CC=CC(=C2C(=O)O)C3=CC=CC=C3)CC

Isomeric SMILES

CCC(C)C1=CN(C(=O)N1CC2=CC=CC(=C2C(=O)O)C3=CC=CC=C3)CC

InChI

InChI=1S/C23H26N2O3/c1-4-16(3)20-15-24(5-2)23(28)25(20)14-18-12-9-13-19(21(18)22(26)27)17-10-7-6-8-11-17/h6-13,15-16H,4-5,14H2,1-3H3,(H,26,27)