1-[2-[4-(thiophen-3-ylmethyl)phenoxy]ethyl]piperidine-4-carboxylic acid

Systemtic Name: 1-[2-[4-(thiophen-3-ylmethyl)phenoxy]ethyl]piperidine-4-carboxylic acid Openeye Name: 1-[2-[4-(3-thienylmethyl)phenoxy]ethyl]piperidine-4-carboxylic acid CAS Name: 1-[2-[4-(3-thiophenylmethyl)phenoxy]ethyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[2-[4-(thiophen-3-ylmethyl)phenoxy]ethyl]piperidine-4-carboxylic acid Traditional Name: 1-[2-[4-(3-thenyl)phenoxy]ethyl]isonipecotic acid Formula: C19H23NO3S MolecularWeight: 345.45582

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)O)CCOC2=CC=C(C=C2)CC3=CSC=C3

Isomeric SMILES

C1CN(CCC1C(=O)O)CCOC2=CC=C(C=C2)CC3=CSC=C3

InChI

InChI=1S/C19H23NO3S/c21-19(22)17-5-8-20(9-6-17)10-11-23-18-3-1-15(2-4-18)13-16-7-12-24-14-16/h1-4,7,12,14,17H,5-6,8-11,13H2,(H,21,22)