4-[(2-butylimidazol-1-yl)methyl]-3-chloranyl-benzoic acid

Systemtic Name: 4-[(2-butylimidazol-1-yl)methyl]-3-chloranyl-benzoic acid Openeye Name: 4-[(2-butylimidazol-1-yl)methyl]-3-chloro-benzoic acid CAS Name: 4-[(2-butyl-1-imidazolyl)methyl]-3-chlorobenzoic acid IUPAC Name: 4-[(2-butylimidazol-1-yl)methyl]-3-chlorobenzoic acid Traditional Name: 4-[(2-butylimidazol-1-yl)methyl]-3-chloro-benzoic acid Formula: C15H17ClN2O2 MolecularWeight: 292.76068

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC=CN1CC2=C(C=C(C=C2)C(=O)O)Cl

Isomeric SMILES

CCCCC1=NC=CN1CC2=C(C=C(C=C2)C(=O)O)Cl

InChI

InChI=1S/C15H17ClN2O2/c1-2-3-4-14-17-7-8-18(14)10-12-6-5-11(15(19)20)9-13(12)16/h5-9H,2-4,10H2,1H3,(H,19,20)