3-(azepan-1-ylsulfonyl)-4-chloranyl-N-[3-(2-methylpropoxy)propyl]benzamide

Systemtic Name: 3-(azepan-1-ylsulfonyl)-4-chloranyl-N-[3-(2-methylpropoxy)propyl]benzamide Openeye Name: 3-(azepan-1-ylsulfonyl)-4-chloro-N-(3-isobutoxypropyl)benzamide CAS Name: 3-(1-azepanylsulfonyl)-4-chloro-N-[3-(2-methylpropoxy)propyl]benzamide IUPAC Name: 3-(azepan-1-ylsulfonyl)-4-chloro-N-[3-(2-methylpropoxy)propyl]benzamide Traditional Name: 3-(azepan-1-ylsulfonyl)-4-chloro-N-(3-isobutoxypropyl)benzamide Formula: C20H31ClN2O4S MolecularWeight: 430.98914

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)COCCCNC(=O)C1=CC(=C(C=C1)Cl)S(=O)(=O)N2CCCCCC2

Isomeric SMILES

CC(C)COCCCNC(=O)C1=CC(=C(C=C1)Cl)S(=O)(=O)N2CCCCCC2

InChI

InChI=1S/C20H31ClN2O4S/c1-16(2)15-27-13-7-10-22-20(24)17-8-9-18(21)19(14-17)28(25,26)23-11-5-3-4-6-12-23/h8-9,14,16H,3-7,10-13,15H2,1-2H3,(H,22,24)