2-[2-butyl-5-chloranyl-1-(phenylmethyl)imidazol-4-yl]ethanoic acid

Systemtic Name: 2-[2-butyl-5-chloranyl-1-(phenylmethyl)imidazol-4-yl]ethanoic acid Openeye Name: 2-(1-benzyl-2-butyl-5-chloro-imidazol-4-yl)acetic acid CAS Name: 2-[2-butyl-5-chloro-1-(phenylmethyl)-4-imidazolyl]acetic acid IUPAC Name: 2-(1-benzyl-2-butyl-5-chloroimidazol-4-yl)acetic acid Traditional Name: 2-(1-benzyl-2-butyl-5-chloro-imidazol-4-yl)acetic acid Formula: C16H19ClN2O2 MolecularWeight: 306.78726

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC(=C(N1CC2=CC=CC=C2)Cl)CC(=O)O

Isomeric SMILES

CCCCC1=NC(=C(N1CC2=CC=CC=C2)Cl)CC(=O)O

InChI

InChI=1S/C16H19ClN2O2/c1-2-3-9-14-18-13(10-15(20)21)16(17)19(14)11-12-7-5-4-6-8-12/h4-8H,2-3,9-11H2,1H3,(H,20,21)