1-[(4-methyl-1,3-thiazol-2-yl)-phenyl-methyl]piperidine-4-carboxylic acid

Systemtic Name: 1-[(4-methyl-1,3-thiazol-2-yl)-phenyl-methyl]piperidine-4-carboxylic acid Openeye Name: 1-[(4-methylthiazol-2-yl)-phenyl-methyl]piperidine-4-carboxylic acid CAS Name: 1-[(4-methyl-2-thiazolyl)-phenylmethyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[(4-methyl-1,3-thiazol-2-yl)-phenylmethyl]piperidine-4-carboxylic acid Traditional Name: 1-[(4-methylthiazol-2-yl)-phenyl-methyl]isonipecotic acid Formula: C17H20N2O2S MolecularWeight: 316.4179

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=N1)C(C2=CC=CC=C2)N3CCC(CC3)C(=O)O

Isomeric SMILES

CC1=CSC(=N1)C(C2=CC=CC=C2)N3CCC(CC3)C(=O)O

InChI

InChI=1S/C17H20N2O2S/c1-12-11-22-16(18-12)15(13-5-3-2-4-6-13)19-9-7-14(8-10-19)17(20)21/h2-6,11,14-15H,7-10H2,1H3,(H,20,21)