N-[(4-ethoxy-3-methoxy-phenyl)methyl]-1-(4-methylpiperidin-1-yl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[(4-ethoxy-3-methoxy-phenyl)methyl]-1-(4-methylpiperidin-1-yl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-[(4-ethoxy-3-methoxy-phenyl)methyl]-1-[(4-methyl-1-piperidyl)sulfonyl]piperidine-4-carboxamide CAS Name: N-[(4-ethoxy-3-methoxyphenyl)methyl]-1-[(4-methyl-1-piperidinyl)sulfonyl]-4-piperidinecarboxamide IUPAC Name: N-[(4-ethoxy-3-methoxyphenyl)methyl]-1-(4-methylpiperidin-1-yl)sulfonylpiperidine-4-carboxamide Traditional Name: N-(4-ethoxy-3-methoxy-benzyl)-1-(4-methylpiperidino)sulfonyl-isonipecotamide Formula: C22H35N3O5S MolecularWeight: 453.5954

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CNC(=O)C2CCN(CC2)S(=O)(=O)N3CCC(CC3)C)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1)CNC(=O)C2CCN(CC2)S(=O)(=O)N3CCC(CC3)C)OC

InChI

InChI=1S/C22H35N3O5S/c1-4-30-20-6-5-18(15-21(20)29-3)16-23-22(26)19-9-13-25(14-10-19)31(27,28)24-11-7-17(2)8-12-24/h5-6,15,17,19H,4,7-14,16H2,1-3H3,(H,23,26)