N-[(4-ethoxy-3-methoxy-phenyl)methyl]-1-pyrrolidin-1-ylsulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[(4-ethoxy-3-methoxy-phenyl)methyl]-1-pyrrolidin-1-ylsulfonyl-piperidine-4-carboxamide Openeye Name: N-[(4-ethoxy-3-methoxy-phenyl)methyl]-1-pyrrolidin-1-ylsulfonyl-piperidine-4-carboxamide CAS Name: N-[(4-ethoxy-3-methoxyphenyl)methyl]-1-(1-pyrrolidinylsulfonyl)-4-piperidinecarboxamide IUPAC Name: N-[(4-ethoxy-3-methoxyphenyl)methyl]-1-pyrrolidin-1-ylsulfonylpiperidine-4-carboxamide Traditional Name: N-(4-ethoxy-3-methoxy-benzyl)-1-pyrrolidinosulfonyl-isonipecotamide Formula: C20H31N3O5S MolecularWeight: 425.54224

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CNC(=O)C2CCN(CC2)S(=O)(=O)N3CCCC3)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1)CNC(=O)C2CCN(CC2)S(=O)(=O)N3CCCC3)OC

InChI

InChI=1S/C20H31N3O5S/c1-3-28-18-7-6-16(14-19(18)27-2)15-21-20(24)17-8-12-23(13-9-17)29(25,26)22-10-4-5-11-22/h6-7,14,17H,3-5,8-13,15H2,1-2H3,(H,21,24)