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

Systemtic Name: 2-[4-[(2-butyl-4-cyclopropyl-4-methyl-5-oxidanylidene-imidazol-1-yl)methyl]phenyl]benzoic acid Openeye Name: 2-[4-[(2-butyl-4-cyclopropyl-4-methyl-5-oxo-imidazol-1-yl)methyl]phenyl]benzoic acid CAS Name: 2-[4-[(2-butyl-4-cyclopropyl-4-methyl-5-oxo-1-imidazolyl)methyl]phenyl]benzoic acid IUPAC Name: 2-[4-[(2-butyl-4-cyclopropyl-4-methyl-5-oxoimidazol-1-yl)methyl]phenyl]benzoic acid Traditional Name: 2-[4-[(2-butyl-4-cyclopropyl-5-keto-4-methyl-2-imidazolin-1-yl)methyl]phenyl]benzoic acid Formula: C25H28N2O3 MolecularWeight: 404.50142

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC(C(=O)N1CC2=CC=C(C=C2)C3=CC=CC=C3C(=O)O)(C)C4CC4

Isomeric SMILES

CCCCC1=NC(C(=O)N1CC2=CC=C(C=C2)C3=CC=CC=C3C(=O)O)(C)C4CC4

InChI

InChI=1S/C25H28N2O3/c1-3-4-9-22-26-25(2,19-14-15-19)24(30)27(22)16-17-10-12-18(13-11-17)20-7-5-6-8-21(20)23(28)29/h5-8,10-13,19H,3-4,9,14-16H2,1-2H3,(H,28,29)