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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(C2=C(C(=CC=C2)Cl)Cl)C3=CC=CS3)C(=O)O

Isomeric SMILES

C1CC(CN(C1)C(C2=C(C(=CC=C2)Cl)Cl)C3=CC=CS3)C(=O)O

InChI

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