N-[2-(3,4-diethoxyphenyl)ethyl]-1-pyridin-3-ylsulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[2-(3,4-diethoxyphenyl)ethyl]-1-pyridin-3-ylsulfonyl-piperidine-4-carboxamide Openeye Name: N-[2-(3,4-diethoxyphenyl)ethyl]-1-(3-pyridylsulfonyl)piperidine-4-carboxamide CAS Name: N-[2-(3,4-diethoxyphenyl)ethyl]-1-(3-pyridinylsulfonyl)-4-piperidinecarboxamide IUPAC Name: N-[2-(3,4-diethoxyphenyl)ethyl]-1-pyridin-3-ylsulfonylpiperidine-4-carboxamide Traditional Name: N-[2-(3,4-diethoxyphenyl)ethyl]-1-(3-pyridylsulfonyl)isonipecotamide Formula: C23H31N3O5S MolecularWeight: 461.57434

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CCNC(=O)C2CCN(CC2)S(=O)(=O)C3=CN=CC=C3)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)CCNC(=O)C2CCN(CC2)S(=O)(=O)C3=CN=CC=C3)OCC

InChI

InChI=1S/C23H31N3O5S/c1-3-30-21-8-7-18(16-22(21)31-4-2)9-13-25-23(27)19-10-14-26(15-11-19)32(28,29)20-6-5-12-24-17-20/h5-8,12,16-17,19H,3-4,9-11,13-15H2,1-2H3,(H,25,27)