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

Systemtic Name: 2-[(3-butyl-5-tert-butyl-2-oxidanylidene-imidazol-1-yl)methyl]-6-phenyl-benzoic acid Openeye Name: 2-[(3-butyl-5-tert-butyl-2-oxo-imidazol-1-yl)methyl]-6-phenyl-benzoic acid CAS Name: 2-[(3-butyl-5-tert-butyl-2-oxo-1-imidazolyl)methyl]-6-phenylbenzoic acid IUPAC Name: 2-[(3-butyl-5-tert-butyl-2-oxoimidazol-1-yl)methyl]-6-phenylbenzoic acid Traditional Name: 2-[(3-butyl-5-tert-butyl-2-keto-4-imidazolin-1-yl)methyl]-6-phenyl-benzoic acid Formula: C25H30N2O3 MolecularWeight: 406.5173

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C=C(N(C1=O)CC2=CC=CC(=C2C(=O)O)C3=CC=CC=C3)C(C)(C)C

Isomeric SMILES

CCCCN1C=C(N(C1=O)CC2=CC=CC(=C2C(=O)O)C3=CC=CC=C3)C(C)(C)C

InChI

InChI=1S/C25H30N2O3/c1-5-6-15-26-17-21(25(2,3)4)27(24(26)30)16-19-13-10-14-20(22(19)23(28)29)18-11-8-7-9-12-18/h7-14,17H,5-6,15-16H2,1-4H3,(H,28,29)