1-[[2,3-bis(chloranyl)phenyl]-(5-chloranylthiophen-2-yl)methyl]piperidine-4-carboxylic acid

Systemtic Name: 1-[[2,3-bis(chloranyl)phenyl]-(5-chloranylthiophen-2-yl)methyl]piperidine-4-carboxylic acid Openeye Name: 1-[(5-chloro-2-thienyl)-(2,3-dichlorophenyl)methyl]piperidine-4-carboxylic acid CAS Name: 1-[(5-chloro-2-thiophenyl)-(2,3-dichlorophenyl)methyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[(5-chlorothiophen-2-yl)-(2,3-dichlorophenyl)methyl]piperidine-4-carboxylic acid Traditional Name: 1-[(5-chloro-2-thienyl)-(2,3-dichlorophenyl)methyl]isonipecotic acid Formula: C17H16Cl3NO2S MolecularWeight: 404.73844

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)O)C(C2=C(C(=CC=C2)Cl)Cl)C3=CC=C(S3)Cl

Isomeric SMILES

C1CN(CCC1C(=O)O)C(C2=C(C(=CC=C2)Cl)Cl)C3=CC=C(S3)Cl

InChI

InChI=1S/C17H16Cl3NO2S/c18-12-3-1-2-11(15(12)20)16(13-4-5-14(19)24-13)21-8-6-10(7-9-21)17(22)23/h1-5,10,16H,6-9H2,(H,22,23)