1-[(5-chloranylthiophen-2-yl)-(4-ethoxyphenyl)methyl]piperidine-2-carboxylic acid

Systemtic Name: 1-[(5-chloranylthiophen-2-yl)-(4-ethoxyphenyl)methyl]piperidine-2-carboxylic acid Openeye Name: 1-[(5-chloro-2-thienyl)-(4-ethoxyphenyl)methyl]piperidine-2-carboxylic acid CAS Name: 1-[(5-chloro-2-thiophenyl)-(4-ethoxyphenyl)methyl]-2-piperidinecarboxylic acid IUPAC Name: 1-[(5-chlorothiophen-2-yl)-(4-ethoxyphenyl)methyl]piperidine-2-carboxylic acid Traditional Name: 1-[(5-chloro-2-thienyl)-p-phenetyl-methyl]pipecolinic acid Formula: C19H22ClNO3S MolecularWeight: 379.90088

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(C2=CC=C(S2)Cl)N3CCCCC3C(=O)O

Isomeric SMILES

CCOC1=CC=C(C=C1)C(C2=CC=C(S2)Cl)N3CCCCC3C(=O)O

InChI

InChI=1S/C19H22ClNO3S/c1-2-24-14-8-6-13(7-9-14)18(16-10-11-17(20)25-16)21-12-4-3-5-15(21)19(22)23/h6-11,15,18H,2-5,12H2,1H3,(H,22,23)