1-[(3-methylthiophen-2-yl)-pyridin-3-yl-methyl]piperidine-2-carboxylic acid

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)C(C2=CN=CC=C2)N3CCCCC3C(=O)O

Isomeric SMILES

CC1=C(SC=C1)C(C2=CN=CC=C2)N3CCCCC3C(=O)O

InChI

InChI=1S/C17H20N2O2S/c1-12-7-10-22-16(12)15(13-5-4-8-18-11-13)19-9-3-2-6-14(19)17(20)21/h4-5,7-8,10-11,14-15H,2-3,6,9H2,1H3,(H,20,21)