4-[[2-butyl-4-(carboxymethyl)-3-chloranyl-2H-imidazol-1-yl]methyl]benzoic acid

Systemtic Name: 4-[[2-butyl-4-(carboxymethyl)-3-chloranyl-2H-imidazol-1-yl]methyl]benzoic acid Openeye Name: 4-[[2-butyl-4-(carboxymethyl)-3-chloro-2H-imidazol-1-yl]methyl]benzoic acid CAS Name: 4-[[2-butyl-4-(carboxymethyl)-3-chloro-2H-imidazol-1-yl]methyl]benzoic acid IUPAC Name: 4-[[2-butyl-4-(carboxymethyl)-3-chloro-2H-imidazol-1-yl]methyl]benzoic acid Traditional Name: 4-[[2-butyl-4-(carboxymethyl)-3-chloro-4-imidazolin-1-yl]methyl]benzoic acid Formula: C17H21ClN2O4 MolecularWeight: 352.81264

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1N(C=C(N1Cl)CC(=O)O)CC2=CC=C(C=C2)C(=O)O

Isomeric SMILES

CCCCC1N(C=C(N1Cl)CC(=O)O)CC2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C17H21ClN2O4/c1-2-3-4-15-19(11-14(20(15)18)9-16(21)22)10-12-5-7-13(8-6-12)17(23)24/h5-8,11,15H,2-4,9-10H2,1H3,(H,21,22)(H,23,24)