1-[(1-methylpyrrol-2-yl)-thiophen-2-yl-methyl]piperidine-4-carboxylic acid

Systemtic Name: 1-[(1-methylpyrrol-2-yl)-thiophen-2-yl-methyl]piperidine-4-carboxylic acid Openeye Name: 1-[(1-methylpyrrol-2-yl)-(2-thienyl)methyl]piperidine-4-carboxylic acid CAS Name: 1-[(1-methyl-2-pyrrolyl)-thiophen-2-ylmethyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[(1-methylpyrrol-2-yl)-thiophen-2-ylmethyl]piperidine-4-carboxylic acid Traditional Name: 1-[(1-methylpyrrol-2-yl)-(2-thienyl)methyl]isonipecotic acid Formula: C16H20N2O2S MolecularWeight: 304.4072

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC=C1C(C2=CC=CS2)N3CCC(CC3)C(=O)O

Isomeric SMILES

CN1C=CC=C1C(C2=CC=CS2)N3CCC(CC3)C(=O)O

InChI

InChI=1S/C16H20N2O2S/c1-17-8-2-4-13(17)15(14-5-3-11-21-14)18-9-6-12(7-10-18)16(19)20/h2-5,8,11-12,15H,6-7,9-10H2,1H3,(H,19,20)