4-chloranyl-3-piperidin-1-ylsulfonyl-N-[(2,4,5-trimethoxyphenyl)methyl]benzamide

Systemtic Name: 4-chloranyl-3-piperidin-1-ylsulfonyl-N-[(2,4,5-trimethoxyphenyl)methyl]benzamide Openeye Name: 4-chloro-3-(1-piperidylsulfonyl)-N-[(2,4,5-trimethoxyphenyl)methyl]benzamide CAS Name: 4-chloro-3-(1-piperidinylsulfonyl)-N-[(2,4,5-trimethoxyphenyl)methyl]benzamide IUPAC Name: 4-chloro-3-piperidin-1-ylsulfonyl-N-[(2,4,5-trimethoxyphenyl)methyl]benzamide Traditional Name: 4-chloro-3-piperidinosulfonyl-N-(2,4,5-trimethoxybenzyl)benzamide Formula: C22H27ClN2O6S MolecularWeight: 482.97758

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1CNC(=O)C2=CC(=C(C=C2)Cl)S(=O)(=O)N3CCCCC3)OC)OC

Isomeric SMILES

COC1=CC(=C(C=C1CNC(=O)C2=CC(=C(C=C2)Cl)S(=O)(=O)N3CCCCC3)OC)OC

InChI

InChI=1S/C22H27ClN2O6S/c1-29-18-13-20(31-3)19(30-2)11-16(18)14-24-22(26)15-7-8-17(23)21(12-15)32(27,28)25-9-5-4-6-10-25/h7-8,11-13H,4-6,9-10,14H2,1-3H3,(H,24,26)