1-[(2,4-dichlorophenyl)-(1-methylimidazol-2-yl)methyl]piperidine-4-carboxylic acid

Systemtic Name: 1-[(2,4-dichlorophenyl)-(1-methylimidazol-2-yl)methyl]piperidine-4-carboxylic acid Openeye Name: 1-[(2,4-dichlorophenyl)-(1-methylimidazol-2-yl)methyl]piperidine-4-carboxylic acid CAS Name: 1-[(2,4-dichlorophenyl)-(1-methyl-2-imidazolyl)methyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[(2,4-dichlorophenyl)-(1-methylimidazol-2-yl)methyl]piperidine-4-carboxylic acid Traditional Name: 1-[(2,4-dichlorophenyl)-(1-methylimidazol-2-yl)methyl]isonipecotic acid Formula: C17H19Cl2N3O2 MolecularWeight: 368.25766

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1C(C2=C(C=C(C=C2)Cl)Cl)N3CCC(CC3)C(=O)O

Isomeric SMILES

CN1C=CN=C1C(C2=C(C=C(C=C2)Cl)Cl)N3CCC(CC3)C(=O)O

InChI

InChI=1S/C17H19Cl2N3O2/c1-21-9-6-20-16(21)15(13-3-2-12(18)10-14(13)19)22-7-4-11(5-8-22)17(23)24/h2-3,6,9-11,15H,4-5,7-8H2,1H3,(H,23,24)