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

Systemtic Name: ethyl 1-[2-[4-(thiophen-3-ylmethyl)phenoxy]ethyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[2-[4-(3-thienylmethyl)phenoxy]ethyl]piperidine-4-carboxylate CAS Name: 1-[2-[4-(3-thiophenylmethyl)phenoxy]ethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-[4-(thiophen-3-ylmethyl)phenoxy]ethyl]piperidine-4-carboxylate Traditional Name: 1-[2-[4-(3-thenyl)phenoxy]ethyl]isonipecotic acid ethyl ester Formula: C21H27NO3S MolecularWeight: 373.50898

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)CCOC2=CC=C(C=C2)CC3=CSC=C3

Isomeric SMILES

CCOC(=O)C1CCN(CC1)CCOC2=CC=C(C=C2)CC3=CSC=C3

InChI

InChI=1S/C21H27NO3S/c1-2-24-21(23)19-7-10-22(11-8-19)12-13-25-20-5-3-17(4-6-20)15-18-9-14-26-16-18/h3-6,9,14,16,19H,2,7-8,10-13,15H2,1H3