1-[(5-methylthiophen-2-yl)-quinolin-3-yl-methyl]piperidine-2-carboxylic acid

Systemtic Name: 1-[(5-methylthiophen-2-yl)-quinolin-3-yl-methyl]piperidine-2-carboxylic acid Openeye Name: 1-[(5-methyl-2-thienyl)-(3-quinolyl)methyl]piperidine-2-carboxylic acid CAS Name: 1-[(5-methyl-2-thiophenyl)-(3-quinolinyl)methyl]-2-piperidinecarboxylic acid IUPAC Name: 1-[(5-methylthiophen-2-yl)-quinolin-3-ylmethyl]piperidine-2-carboxylic acid Traditional Name: 1-[(5-methyl-2-thienyl)-(3-quinolyl)methyl]pipecolinic acid Formula: C21H22N2O2S MolecularWeight: 366.47658

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)C(C2=CC3=CC=CC=C3N=C2)N4CCCCC4C(=O)O

Isomeric SMILES

CC1=CC=C(S1)C(C2=CC3=CC=CC=C3N=C2)N4CCCCC4C(=O)O

InChI

InChI=1S/C21H22N2O2S/c1-14-9-10-19(26-14)20(23-11-5-4-8-18(23)21(24)25)16-12-15-6-2-3-7-17(15)22-13-16/h2-3,6-7,9-10,12-13,18,20H,4-5,8,11H2,1H3,(H,24,25)