1-[(3-chloranyl-1-benzothiophen-2-yl)methyl]piperidine-3-carboxylic acid

Systemtic Name: 1-[(3-chloranyl-1-benzothiophen-2-yl)methyl]piperidine-3-carboxylic acid Openeye Name: 1-[(3-chlorobenzothiophen-2-yl)methyl]piperidine-3-carboxylic acid CAS Name: 1-[(3-chloro-1-benzothiophen-2-yl)methyl]-3-piperidinecarboxylic acid IUPAC Name: 1-[(3-chloro-1-benzothiophen-2-yl)methyl]piperidine-3-carboxylic acid Traditional Name: 1-[(3-chlorobenzothiophen-2-yl)methyl]nipecotic acid Formula: C15H16ClNO2S MolecularWeight: 309.81104

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)CC2=C(C3=CC=CC=C3S2)Cl)C(=O)O

Isomeric SMILES

C1CC(CN(C1)CC2=C(C3=CC=CC=C3S2)Cl)C(=O)O

InChI

InChI=1S/C15H16ClNO2S/c16-14-11-5-1-2-6-12(11)20-13(14)9-17-7-3-4-10(8-17)15(18)19/h1-2,5-6,10H,3-4,7-9H2,(H,18,19)