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

Systemtic Name: N-[(3,4-dimethoxyphenyl)methyl]-4-methoxy-3-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-[(3,4-dimethoxyphenyl)methyl]-4-methoxy-3-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: N-[(3,4-dimethoxyphenyl)methyl]-4-methoxy-3-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-[(3,4-dimethoxyphenyl)methyl]-4-methoxy-3-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: 4-methoxy-3-pyrrolidinosulfonyl-N-veratryl-benzamide Formula: C21H26N2O6S MolecularWeight: 434.50594

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H26N2O6S/c1-27-17-8-6-15(12-19(17)29-3)14-22-21(24)16-7-9-18(28-2)20(13-16)30(25,26)23-10-4-5-11-23/h6-9,12-13H,4-5,10-11,14H2,1-3H3,(H,22,24)