N-[2-(3,4-dimethoxyphenyl)ethyl]-N,1-dimethyl-4-piperidin-1-ylsulfonyl-pyrrole-2-carboxamide

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-N,1-dimethyl-4-piperidin-1-ylsulfonyl-pyrrole-2-carboxamide Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-N,1-dimethyl-4-(1-piperidylsulfonyl)pyrrole-2-carboxamide CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-N,1-dimethyl-4-(1-piperidinylsulfonyl)-2-pyrrolecarboxamide IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-N,1-dimethyl-4-piperidin-1-ylsulfonylpyrrole-2-carboxamide Traditional Name: N-homoveratryl-N,1-dimethyl-4-piperidinosulfonyl-pyrrole-2-carboxamide Formula: C22H31N3O5S MolecularWeight: 449.56364

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=C1C(=O)N(C)CCC2=CC(=C(C=C2)OC)OC)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CN1C=C(C=C1C(=O)N(C)CCC2=CC(=C(C=C2)OC)OC)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C22H31N3O5S/c1-23(13-10-17-8-9-20(29-3)21(14-17)30-4)22(26)19-15-18(16-24(19)2)31(27,28)25-11-6-5-7-12-25/h8-9,14-16H,5-7,10-13H2,1-4H3