1-[[2,3-bis(chloranyl)phenyl]-thiophen-3-yl-methyl]piperidine-3-carboxylic acid

Systemtic Name: 1-[[2,3-bis(chloranyl)phenyl]-thiophen-3-yl-methyl]piperidine-3-carboxylic acid Openeye Name: 1-[(2,3-dichlorophenyl)-(3-thienyl)methyl]piperidine-3-carboxylic acid CAS Name: 1-[(2,3-dichlorophenyl)-(3-thiophenyl)methyl]-3-piperidinecarboxylic acid IUPAC Name: 1-[(2,3-dichlorophenyl)-thiophen-3-ylmethyl]piperidine-3-carboxylic acid Traditional Name: 1-[(2,3-dichlorophenyl)-(3-thienyl)methyl]nipecotic acid Formula: C17H17Cl2NO2S MolecularWeight: 370.29338

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(C2=CSC=C2)C3=C(C(=CC=C3)Cl)Cl)C(=O)O

Isomeric SMILES

C1CC(CN(C1)C(C2=CSC=C2)C3=C(C(=CC=C3)Cl)Cl)C(=O)O

InChI

InChI=1S/C17H17Cl2NO2S/c18-14-5-1-4-13(15(14)19)16(12-6-8-23-10-12)20-7-2-3-11(9-20)17(21)22/h1,4-6,8,10-11,16H,2-3,7,9H2,(H,21,22)