N-[1-(3,4-diethoxyphenyl)-2-methyl-propyl]-1-ethylsulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[1-(3,4-diethoxyphenyl)-2-methyl-propyl]-1-ethylsulfonyl-piperidine-4-carboxamide Openeye Name: N-[1-(3,4-diethoxyphenyl)-2-methyl-propyl]-1-ethylsulfonyl-piperidine-4-carboxamide CAS Name: N-[1-(3,4-diethoxyphenyl)-2-methylpropyl]-1-ethylsulfonyl-4-piperidinecarboxamide IUPAC Name: N-[1-(3,4-diethoxyphenyl)-2-methylpropyl]-1-ethylsulfonylpiperidine-4-carboxamide Traditional Name: N-[1-(3,4-diethoxyphenyl)-2-methyl-propyl]-1-esyl-isonipecotamide Formula: C22H36N2O5S MolecularWeight: 440.59664

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H36N2O5S/c1-6-28-19-10-9-18(15-20(19)29-7-2)21(16(4)5)23-22(25)17-11-13-24(14-12-17)30(26,27)8-3/h9-10,15-17,21H,6-8,11-14H2,1-5H3,(H,23,25)