N-[(3,4-dimethoxyphenyl)methyl]-4-(pyrrolidin-1-ylsulfonylmethyl)benzamide

Systemtic Name: N-[(3,4-dimethoxyphenyl)methyl]-4-(pyrrolidin-1-ylsulfonylmethyl)benzamide Openeye Name: N-[(3,4-dimethoxyphenyl)methyl]-4-(pyrrolidin-1-ylsulfonylmethyl)benzamide CAS Name: N-[(3,4-dimethoxyphenyl)methyl]-4-(1-pyrrolidinylsulfonylmethyl)benzamide IUPAC Name: N-[(3,4-dimethoxyphenyl)methyl]-4-(pyrrolidin-1-ylsulfonylmethyl)benzamide Traditional Name: 4-(pyrrolidinosulfonylmethyl)-N-veratryl-benzamide Formula: C21H26N2O5S MolecularWeight: 418.50654

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC(=O)C2=CC=C(C=C2)CS(=O)(=O)N3CCCC3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CNC(=O)C2=CC=C(C=C2)CS(=O)(=O)N3CCCC3)OC

InChI

InChI=1S/C21H26N2O5S/c1-27-19-10-7-17(13-20(19)28-2)14-22-21(24)18-8-5-16(6-9-18)15-29(25,26)23-11-3-4-12-23/h5-10,13H,3-4,11-12,14-15H2,1-2H3,(H,22,24)