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2-[4-[2-(2-butyl-5-chloranyl-1H-imidazol-4-yl)-2-oxidanylidene-ethyl]phenyl]benzoic acid

2-[4-[2-(2-butyl-5-chloranyl-1H-imidazol-4-yl)-2-oxidanylidene-ethyl]phenyl]benzoic acid

Systemtic Name:2-[4-[2-(2-butyl-5-chloranyl-1H-imidazol-4-yl)-2-oxidanylidene-ethyl]phenyl]benzoic acid
Openeye Name:2-[4-[2-(2-butyl-5-chloro-1H-imidazol-4-yl)-2-oxo-ethyl]phenyl]benzoic acid
CAS Name:2-[4-[2-(2-butyl-5-chloro-1H-imidazol-4-yl)-2-oxoethyl]phenyl]benzoic acid
IUPAC Name:2-[4-[2-(2-butyl-5-chloro-1H-imidazol-4-yl)-2-oxoethyl]phenyl]benzoic acid
Traditional Name:2-[4-[2-(2-butyl-5-chloro-1H-imidazol-4-yl)-2-keto-ethyl]phenyl]benzoic acid
Formula: C22H21ClN2O3
MolecularWeight: 396.86674
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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC(=C(N1)Cl)C(=O)CC2=CC=C(C=C2)C3=CC=CC=C3C(=O)O


Isomeric SMILES

CCCCC1=NC(=C(N1)Cl)C(=O)CC2=CC=C(C=C2)C3=CC=CC=C3C(=O)O


InChI

InChI=1S/C22H21ClN2O3/c1-2-3-8-19-24-20(21(23)25-19)18(26)13-14-9-11-15(12-10-14)16-6-4-5-7-17(16)22(27)28/h4-7,9-12H,2-3,8,13H2,1H3,(H,24,25)(H,27,28)


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