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

Systemtic Name: N-[(3,4-dimethoxyphenyl)methyl]-3-piperidin-1-ylsulfonyl-benzamide Openeye Name: N-[(3,4-dimethoxyphenyl)methyl]-3-(1-piperidylsulfonyl)benzamide CAS Name: N-[(3,4-dimethoxyphenyl)methyl]-3-(1-piperidinylsulfonyl)benzamide IUPAC Name: N-[(3,4-dimethoxyphenyl)methyl]-3-piperidin-1-ylsulfonylbenzamide Traditional Name: 3-piperidinosulfonyl-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(=CC=C2)S(=O)(=O)N3CCCCC3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CNC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCCCC3)OC

InChI

InChI=1S/C21H26N2O5S/c1-27-19-10-9-16(13-20(19)28-2)15-22-21(24)17-7-6-8-18(14-17)29(25,26)23-11-4-3-5-12-23/h6-10,13-14H,3-5,11-12,15H2,1-2H3,(H,22,24)