N-[1-(4,5-dimethoxy-2-methyl-phenyl)ethyl]-1-propylsulfonyl-piperidine-3-carboxamide

Systemtic Name: N-[1-(4,5-dimethoxy-2-methyl-phenyl)ethyl]-1-propylsulfonyl-piperidine-3-carboxamide Openeye Name: N-[1-(4,5-dimethoxy-2-methyl-phenyl)ethyl]-1-propylsulfonyl-piperidine-3-carboxamide CAS Name: N-[1-(4,5-dimethoxy-2-methylphenyl)ethyl]-1-propylsulfonyl-3-piperidinecarboxamide IUPAC Name: N-[1-(4,5-dimethoxy-2-methylphenyl)ethyl]-1-propylsulfonylpiperidine-3-carboxamide Traditional Name: N-[1-(4,5-dimethoxy-2-methyl-phenyl)ethyl]-1-propylsulfonyl-nipecotamide Formula: C20H32N2O5S MolecularWeight: 412.54348

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Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)N1CCCC(C1)C(=O)NC(C)C2=CC(=C(C=C2C)OC)OC

Isomeric SMILES

CCCS(=O)(=O)N1CCCC(C1)C(=O)NC(C)C2=CC(=C(C=C2C)OC)OC

InChI

InChI=1S/C20H32N2O5S/c1-6-10-28(24,25)22-9-7-8-16(13-22)20(23)21-15(3)17-12-19(27-5)18(26-4)11-14(17)2/h11-12,15-16H,6-10,13H2,1-5H3,(H,21,23)