1-[(3-methylpyridin-4-yl)-thiophen-3-yl-methyl]piperidine-2-carboxylic acid

Systemtic Name: 1-[(3-methylpyridin-4-yl)-thiophen-3-yl-methyl]piperidine-2-carboxylic acid Openeye Name: 1-[(3-methyl-4-pyridyl)-(3-thienyl)methyl]piperidine-2-carboxylic acid CAS Name: 1-[(3-methyl-4-pyridinyl)-(3-thiophenyl)methyl]-2-piperidinecarboxylic acid IUPAC Name: 1-[(3-methylpyridin-4-yl)-thiophen-3-ylmethyl]piperidine-2-carboxylic acid Traditional Name: 1-[(3-methyl-4-pyridyl)-(3-thienyl)methyl]pipecolinic acid Formula: C17H20N2O2S MolecularWeight: 316.4179

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CN=C1)C(C2=CSC=C2)N3CCCCC3C(=O)O

Isomeric SMILES

CC1=C(C=CN=C1)C(C2=CSC=C2)N3CCCCC3C(=O)O

InChI

InChI=1S/C17H20N2O2S/c1-12-10-18-7-5-14(12)16(13-6-9-22-11-13)19-8-3-2-4-15(19)17(20)21/h5-7,9-11,15-16H,2-4,8H2,1H3,(H,20,21)