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

Systemtic Name: 1-[1-benzothiophen-2-yl(thiophen-3-yl)methyl]piperidine-3-carboxylic acid Openeye Name: 1-[benzothiophen-2-yl(3-thienyl)methyl]piperidine-3-carboxylic acid CAS Name: 1-[1-benzothiophen-2-yl(3-thiophenyl)methyl]-3-piperidinecarboxylic acid IUPAC Name: 1-[1-benzothiophen-2-yl(thiophen-3-yl)methyl]piperidine-3-carboxylic acid Traditional Name: 1-[benzothiophen-2-yl(3-thienyl)methyl]nipecotic acid Formula: C19H19NO2S2 MolecularWeight: 357.48966

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(C2=CSC=C2)C3=CC4=CC=CC=C4S3)C(=O)O

Isomeric SMILES

C1CC(CN(C1)C(C2=CSC=C2)C3=CC4=CC=CC=C4S3)C(=O)O

InChI

InChI=1S/C19H19NO2S2/c21-19(22)14-5-3-8-20(11-14)18(15-7-9-23-12-15)17-10-13-4-1-2-6-16(13)24-17/h1-2,4,6-7,9-10,12,14,18H,3,5,8,11H2,(H,21,22)