N-[(3-ethoxyphenyl)methyl]-2-methyl-5-piperidin-1-ylsulfonyl-benzamide

Systemtic Name: N-[(3-ethoxyphenyl)methyl]-2-methyl-5-piperidin-1-ylsulfonyl-benzamide Openeye Name: N-[(3-ethoxyphenyl)methyl]-2-methyl-5-(1-piperidylsulfonyl)benzamide CAS Name: N-[(3-ethoxyphenyl)methyl]-2-methyl-5-(1-piperidinylsulfonyl)benzamide IUPAC Name: N-[(3-ethoxyphenyl)methyl]-2-methyl-5-piperidin-1-ylsulfonylbenzamide Traditional Name: N-(3-ethoxybenzyl)-2-methyl-5-piperidinosulfonyl-benzamide Formula: C22H28N2O4S MolecularWeight: 416.53372

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1)CNC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCCCC3)C

Isomeric SMILES

CCOC1=CC=CC(=C1)CNC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCCCC3)C

InChI

InChI=1S/C22H28N2O4S/c1-3-28-19-9-7-8-18(14-19)16-23-22(25)21-15-20(11-10-17(21)2)29(26,27)24-12-5-4-6-13-24/h7-11,14-15H,3-6,12-13,16H2,1-2H3,(H,23,25)