1-[(2,4-dichlorophenyl)-(3-fluorophenyl)methyl]piperidine-4-carboxylic acid

Systemtic Name: 1-[(2,4-dichlorophenyl)-(3-fluorophenyl)methyl]piperidine-4-carboxylic acid Openeye Name: 1-[(2,4-dichlorophenyl)-(3-fluorophenyl)methyl]piperidine-4-carboxylic acid CAS Name: 1-[(2,4-dichlorophenyl)-(3-fluorophenyl)methyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[(2,4-dichlorophenyl)-(3-fluorophenyl)methyl]piperidine-4-carboxylic acid Traditional Name: 1-[(2,4-dichlorophenyl)-(3-fluorophenyl)methyl]isonipecotic acid Formula: C19H18Cl2FNO2 MolecularWeight: 382.256123

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)O)C(C2=CC(=CC=C2)F)C3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

C1CN(CCC1C(=O)O)C(C2=CC(=CC=C2)F)C3=C(C=C(C=C3)Cl)Cl

InChI

InChI=1S/C19H18Cl2FNO2/c20-14-4-5-16(17(21)11-14)18(13-2-1-3-15(22)10-13)23-8-6-12(7-9-23)19(24)25/h1-5,10-12,18H,6-9H2,(H,24,25)