N-[2-(3,4-dimethoxyphenyl)ethyl]-1-(4-methylpiperidin-1-yl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-1-(4-methylpiperidin-1-yl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-1-[(4-methyl-1-piperidyl)sulfonyl]piperidine-4-carboxamide CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-1-[(4-methyl-1-piperidinyl)sulfonyl]-4-piperidinecarboxamide IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-1-(4-methylpiperidin-1-yl)sulfonylpiperidine-4-carboxamide Traditional Name: N-homoveratryl-1-(4-methylpiperidino)sulfonyl-isonipecotamide Formula: C22H35N3O5S MolecularWeight: 453.5954

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)S(=O)(=O)N2CCC(CC2)C(=O)NCCC3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CC1CCN(CC1)S(=O)(=O)N2CCC(CC2)C(=O)NCCC3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C22H35N3O5S/c1-17-7-12-24(13-8-17)31(27,28)25-14-9-19(10-15-25)22(26)23-11-6-18-4-5-20(29-2)21(16-18)30-3/h4-5,16-17,19H,6-15H2,1-3H3,(H,23,26)