1-[(2,6-dimethoxyphenyl)-thiophen-3-yl-methyl]piperidine-2-carboxylic acid

Systemtic Name: 1-[(2,6-dimethoxyphenyl)-thiophen-3-yl-methyl]piperidine-2-carboxylic acid Openeye Name: 1-[(2,6-dimethoxyphenyl)-(3-thienyl)methyl]piperidine-2-carboxylic acid CAS Name: 1-[(2,6-dimethoxyphenyl)-(3-thiophenyl)methyl]-2-piperidinecarboxylic acid IUPAC Name: 1-[(2,6-dimethoxyphenyl)-thiophen-3-ylmethyl]piperidine-2-carboxylic acid Traditional Name: 1-[(2,6-dimethoxyphenyl)-(3-thienyl)methyl]pipecolinic acid Formula: C19H23NO4S MolecularWeight: 361.45522

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC=C1)OC)C(C2=CSC=C2)N3CCCCC3C(=O)O

Isomeric SMILES

COC1=C(C(=CC=C1)OC)C(C2=CSC=C2)N3CCCCC3C(=O)O

InChI

InChI=1S/C19H23NO4S/c1-23-15-7-5-8-16(24-2)17(15)18(13-9-11-25-12-13)20-10-4-3-6-14(20)19(21)22/h5,7-9,11-12,14,18H,3-4,6,10H2,1-2H3,(H,21,22)