2-[4-[(1-butylimidazol-4-yl)methyl]phenyl]benzoic acid

Systemtic Name: 2-[4-[(1-butylimidazol-4-yl)methyl]phenyl]benzoic acid Openeye Name: 2-[4-[(1-butylimidazol-4-yl)methyl]phenyl]benzoic acid CAS Name: 2-[4-[(1-butyl-4-imidazolyl)methyl]phenyl]benzoic acid IUPAC Name: 2-[4-[(1-butylimidazol-4-yl)methyl]phenyl]benzoic acid Traditional Name: 2-[4-[(1-butylimidazol-4-yl)methyl]phenyl]benzoic acid Formula: C21H22N2O2 MolecularWeight: 334.41158

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C=C(N=C1)CC2=CC=C(C=C2)C3=CC=CC=C3C(=O)O

Isomeric SMILES

CCCCN1C=C(N=C1)CC2=CC=C(C=C2)C3=CC=CC=C3C(=O)O

InChI

InChI=1S/C21H22N2O2/c1-2-3-12-23-14-18(22-15-23)13-16-8-10-17(11-9-16)19-6-4-5-7-20(19)21(24)25/h4-11,14-15H,2-3,12-13H2,1H3,(H,24,25)