1-[(5-ethylthiophen-2-yl)-thiophen-3-yl-methyl]piperidine-3-carboxylic acid

Systemtic Name: 1-[(5-ethylthiophen-2-yl)-thiophen-3-yl-methyl]piperidine-3-carboxylic acid Openeye Name: 1-[(5-ethyl-2-thienyl)-(3-thienyl)methyl]piperidine-3-carboxylic acid CAS Name: 1-[(5-ethyl-2-thiophenyl)-(3-thiophenyl)methyl]-3-piperidinecarboxylic acid IUPAC Name: 1-[(5-ethylthiophen-2-yl)-thiophen-3-ylmethyl]piperidine-3-carboxylic acid Traditional Name: 1-[(5-ethyl-2-thienyl)-(3-thienyl)methyl]nipecotic acid Formula: C17H21NO2S2 MolecularWeight: 335.48414

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(S1)C(C2=CSC=C2)N3CCCC(C3)C(=O)O

Isomeric SMILES

CCC1=CC=C(S1)C(C2=CSC=C2)N3CCCC(C3)C(=O)O

InChI

InChI=1S/C17H21NO2S2/c1-2-14-5-6-15(22-14)16(13-7-9-21-11-13)18-8-3-4-12(10-18)17(19)20/h5-7,9,11-12,16H,2-4,8,10H2,1H3,(H,19,20)