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

Systemtic Name: 1-[(2,4-dichlorophenyl)-(1-methylpyrrol-2-yl)methyl]piperidine-4-carboxylic acid Openeye Name: 1-[(2,4-dichlorophenyl)-(1-methylpyrrol-2-yl)methyl]piperidine-4-carboxylic acid CAS Name: 1-[(2,4-dichlorophenyl)-(1-methyl-2-pyrrolyl)methyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[(2,4-dichlorophenyl)-(1-methylpyrrol-2-yl)methyl]piperidine-4-carboxylic acid Traditional Name: 1-[(2,4-dichlorophenyl)-(1-methylpyrrol-2-yl)methyl]isonipecotic acid Formula: C18H20Cl2N2O2 MolecularWeight: 367.2696

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H20Cl2N2O2/c1-21-8-2-3-16(21)17(14-5-4-13(19)11-15(14)20)22-9-6-12(7-10-22)18(23)24/h2-5,8,11-12,17H,6-7,9-10H2,1H3,(H,23,24)