N-(6-methylheptan-2-yl)-3-(phenylsulfonylmethyl)benzamide

Systemtic Name: N-(6-methylheptan-2-yl)-3-(phenylsulfonylmethyl)benzamide Openeye Name: 3-(benzenesulfonylmethyl)-N-(1,5-dimethylhexyl)benzamide CAS Name: 3-(benzenesulfonylmethyl)-N-(6-methylheptan-2-yl)benzamide IUPAC Name: 3-(benzenesulfonylmethyl)-N-(6-methylheptan-2-yl)benzamide Traditional Name: 3-(besylmethyl)-N-(1,5-dimethylhexyl)benzamide Formula: C22H29NO3S MolecularWeight: 387.53556

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCC(C)NC(=O)C1=CC(=CC=C1)CS(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

CC(C)CCCC(C)NC(=O)C1=CC(=CC=C1)CS(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C22H29NO3S/c1-17(2)9-7-10-18(3)23-22(24)20-12-8-11-19(15-20)16-27(25,26)21-13-5-4-6-14-21/h4-6,8,11-15,17-18H,7,9-10,16H2,1-3H3,(H,23,24)