1-[(5-methylthiophen-2-yl)-naphthalen-2-yl-methyl]piperidine-4-carboxylic acid

Systemtic Name: 1-[(5-methylthiophen-2-yl)-naphthalen-2-yl-methyl]piperidine-4-carboxylic acid Openeye Name: 1-[(5-methyl-2-thienyl)-(2-naphthyl)methyl]piperidine-4-carboxylic acid CAS Name: 1-[(5-methyl-2-thiophenyl)-(2-naphthalenyl)methyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[(5-methylthiophen-2-yl)-naphthalen-2-ylmethyl]piperidine-4-carboxylic acid Traditional Name: 1-[(5-methyl-2-thienyl)-(2-naphthyl)methyl]isonipecotic acid Formula: C22H23NO2S MolecularWeight: 365.48852

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)C(C2=CC3=CC=CC=C3C=C2)N4CCC(CC4)C(=O)O

Isomeric SMILES

CC1=CC=C(S1)C(C2=CC3=CC=CC=C3C=C2)N4CCC(CC4)C(=O)O

InChI

InChI=1S/C22H23NO2S/c1-15-6-9-20(26-15)21(23-12-10-17(11-13-23)22(24)25)19-8-7-16-4-2-3-5-18(16)14-19/h2-9,14,17,21H,10-13H2,1H3,(H,24,25)