1-[(5-ethylthiophen-2-yl)-(3-methylphenyl)methyl]piperidine-2-carboxylic acid

Systemtic Name: 1-[(5-ethylthiophen-2-yl)-(3-methylphenyl)methyl]piperidine-2-carboxylic acid Openeye Name: 1-[(5-ethyl-2-thienyl)-(m-tolyl)methyl]piperidine-2-carboxylic acid CAS Name: 1-[(5-ethyl-2-thiophenyl)-(3-methylphenyl)methyl]-2-piperidinecarboxylic acid IUPAC Name: 1-[(5-ethylthiophen-2-yl)-(3-methylphenyl)methyl]piperidine-2-carboxylic acid Traditional Name: 1-[(5-ethyl-2-thienyl)-(m-tolyl)methyl]pipecolinic acid Formula: C20H25NO2S MolecularWeight: 343.483

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(S1)C(C2=CC=CC(=C2)C)N3CCCCC3C(=O)O

Isomeric SMILES

CCC1=CC=C(S1)C(C2=CC=CC(=C2)C)N3CCCCC3C(=O)O

InChI

InChI=1S/C20H25NO2S/c1-3-16-10-11-18(24-16)19(15-8-6-7-14(2)13-15)21-12-5-4-9-17(21)20(22)23/h6-8,10-11,13,17,19H,3-5,9,12H2,1-2H3,(H,22,23)