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

Systemtic Name: N-[1-(3,4-diethoxyphenyl)ethyl]-1-pyridin-3-ylsulfonyl-piperidine-4-carboxamide Openeye Name: N-[1-(3,4-diethoxyphenyl)ethyl]-1-(3-pyridylsulfonyl)piperidine-4-carboxamide CAS Name: N-[1-(3,4-diethoxyphenyl)ethyl]-1-(3-pyridinylsulfonyl)-4-piperidinecarboxamide IUPAC Name: N-[1-(3,4-diethoxyphenyl)ethyl]-1-pyridin-3-ylsulfonylpiperidine-4-carboxamide Traditional Name: N-[1-(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)C(C)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CN=CC=C3)OCC

Isomeric SMILES

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

InChI

InChI=1S/C23H31N3O5S/c1-4-30-21-9-8-19(15-22(21)31-5-2)17(3)25-23(27)18-10-13-26(14-11-18)32(28,29)20-7-6-12-24-16-20/h6-9,12,15-18H,4-5,10-11,13-14H2,1-3H3,(H,25,27)