3-(azepan-1-ylsulfonyl)-N-tert-butyl-4-chloranyl-benzamide

Systemtic Name: 3-(azepan-1-ylsulfonyl)-N-tert-butyl-4-chloranyl-benzamide Openeye Name: 3-(azepan-1-ylsulfonyl)-N-tert-butyl-4-chloro-benzamide CAS Name: 3-(1-azepanylsulfonyl)-N-tert-butyl-4-chlorobenzamide IUPAC Name: 3-(azepan-1-ylsulfonyl)-N-tert-butyl-4-chlorobenzamide Traditional Name: 3-(azepan-1-ylsulfonyl)-N-tert-butyl-4-chloro-benzamide Formula: C17H25ClN2O3S MolecularWeight: 372.91

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H25ClN2O3S/c1-17(2,3)19-16(21)13-8-9-14(18)15(12-13)24(22,23)20-10-6-4-5-7-11-20/h8-9,12H,4-7,10-11H2,1-3H3,(H,19,21)