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

Systemtic Name: 1-[(3,4-dichlorophenyl)-thiophen-2-yl-methyl]piperidine-2-carboxylic acid Openeye Name: 1-[(3,4-dichlorophenyl)-(2-thienyl)methyl]piperidine-2-carboxylic acid CAS Name: 1-[(3,4-dichlorophenyl)-thiophen-2-ylmethyl]-2-piperidinecarboxylic acid IUPAC Name: 1-[(3,4-dichlorophenyl)-thiophen-2-ylmethyl]piperidine-2-carboxylic acid Traditional Name: 1-[(3,4-dichlorophenyl)-(2-thienyl)methyl]pipecolinic acid Formula: C17H17Cl2NO2S MolecularWeight: 370.29338

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)C(=O)O)C(C2=CC(=C(C=C2)Cl)Cl)C3=CC=CS3

Isomeric SMILES

C1CCN(C(C1)C(=O)O)C(C2=CC(=C(C=C2)Cl)Cl)C3=CC=CS3

InChI

InChI=1S/C17H17Cl2NO2S/c18-12-7-6-11(10-13(12)19)16(15-5-3-9-23-15)20-8-2-1-4-14(20)17(21)22/h3,5-7,9-10,14,16H,1-2,4,8H2,(H,21,22)