1-[(4-ethylphenyl)-thiophen-3-yl-methyl]piperidine-2-carboxylic acid

Systemtic Name: 1-[(4-ethylphenyl)-thiophen-3-yl-methyl]piperidine-2-carboxylic acid Openeye Name: 1-[(4-ethylphenyl)-(3-thienyl)methyl]piperidine-2-carboxylic acid CAS Name: 1-[(4-ethylphenyl)-(3-thiophenyl)methyl]-2-piperidinecarboxylic acid IUPAC Name: 1-[(4-ethylphenyl)-thiophen-3-ylmethyl]piperidine-2-carboxylic acid Traditional Name: 1-[(4-ethylphenyl)-(3-thienyl)methyl]pipecolinic acid Formula: C19H23NO2S MolecularWeight: 329.45642

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(C2=CSC=C2)N3CCCCC3C(=O)O

Isomeric SMILES

CCC1=CC=C(C=C1)C(C2=CSC=C2)N3CCCCC3C(=O)O

InChI

InChI=1S/C19H23NO2S/c1-2-14-6-8-15(9-7-14)18(16-10-12-23-13-16)20-11-4-3-5-17(20)19(21)22/h6-10,12-13,17-18H,2-5,11H2,1H3,(H,21,22)