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

Systemtic Name: 1-[(3-methoxyphenyl)-thiophen-2-yl-methyl]piperidine-2-carboxylic acid Openeye Name: 1-[(3-methoxyphenyl)-(2-thienyl)methyl]piperidine-2-carboxylic acid CAS Name: 1-[(3-methoxyphenyl)-thiophen-2-ylmethyl]-2-piperidinecarboxylic acid IUPAC Name: 1-[(3-methoxyphenyl)-thiophen-2-ylmethyl]piperidine-2-carboxylic acid Traditional Name: 1-[(3-methoxyphenyl)-(2-thienyl)methyl]pipecolinic acid Formula: C18H21NO3S MolecularWeight: 331.42924

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(C2=CC=CS2)N3CCCCC3C(=O)O

Isomeric SMILES

COC1=CC=CC(=C1)C(C2=CC=CS2)N3CCCCC3C(=O)O

InChI

InChI=1S/C18H21NO3S/c1-22-14-7-4-6-13(12-14)17(16-9-5-11-23-16)19-10-3-2-8-15(19)18(20)21/h4-7,9,11-12,15,17H,2-3,8,10H2,1H3,(H,20,21)