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

Systemtic Name: 2-[4-[[(4Z)-2-butyl-5-oxidanylidene-4-(phenylmethylidene)imidazol-1-yl]methyl]phenyl]benzoic acid Openeye Name: 2-[4-[[(4Z)-4-benzylidene-2-butyl-5-oxo-imidazol-1-yl]methyl]phenyl]benzoic acid CAS Name: 2-[4-[[(4Z)-2-butyl-5-oxo-4-(phenylmethylene)-1-imidazolyl]methyl]phenyl]benzoic acid IUPAC Name: 2-[4-[[(4Z)-4-benzylidene-2-butyl-5-oxoimidazol-1-yl]methyl]phenyl]benzoic acid Traditional Name: 2-[4-[[(4Z)-4-benzal-2-butyl-5-keto-2-imidazolin-1-yl]methyl]phenyl]benzoic acid Formula: C28H26N2O3 MolecularWeight: 438.51764

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC(=CC2=CC=CC=C2)C(=O)N1CC3=CC=C(C=C3)C4=CC=CC=C4C(=O)O

Isomeric SMILES

CCCCC1=N/C(=C\C2=CC=CC=C2)/C(=O)N1CC3=CC=C(C=C3)C4=CC=CC=C4C(=O)O

InChI

InChI=1S/C28H26N2O3/c1-2-3-13-26-29-25(18-20-9-5-4-6-10-20)27(31)30(26)19-21-14-16-22(17-15-21)23-11-7-8-12-24(23)28(32)33/h4-12,14-18H,2-3,13,19H2,1H3,(H,32,33)/b25-18-