1-[(5-ethylthiophen-2-yl)-(4-methoxyphenyl)methyl]piperidine-2-carboxylic acid

Systemtic Name: 1-[(5-ethylthiophen-2-yl)-(4-methoxyphenyl)methyl]piperidine-2-carboxylic acid Openeye Name: 1-[(5-ethyl-2-thienyl)-(4-methoxyphenyl)methyl]piperidine-2-carboxylic acid CAS Name: 1-[(5-ethyl-2-thiophenyl)-(4-methoxyphenyl)methyl]-2-piperidinecarboxylic acid IUPAC Name: 1-[(5-ethylthiophen-2-yl)-(4-methoxyphenyl)methyl]piperidine-2-carboxylic acid Traditional Name: 1-[(5-ethyl-2-thienyl)-(4-methoxyphenyl)methyl]pipecolinic acid Formula: C20H25NO3S MolecularWeight: 359.4824

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H25NO3S/c1-3-16-11-12-18(25-16)19(14-7-9-15(24-2)10-8-14)21-13-5-4-6-17(21)20(22)23/h7-12,17,19H,3-6,13H2,1-2H3,(H,22,23)