N-(4-methyl-3-piperidin-1-ylsulfonyl-phenyl)-2-(2-oxidanylideneazepan-1-yl)ethanamide

Systemtic Name: N-(4-methyl-3-piperidin-1-ylsulfonyl-phenyl)-2-(2-oxidanylideneazepan-1-yl)ethanamide Openeye Name: N-[4-methyl-3-(1-piperidylsulfonyl)phenyl]-2-(2-oxoazepan-1-yl)acetamide CAS Name: N-[4-methyl-3-(1-piperidinylsulfonyl)phenyl]-2-(2-oxo-1-azepanyl)acetamide IUPAC Name: N-(4-methyl-3-piperidin-1-ylsulfonylphenyl)-2-(2-oxoazepan-1-yl)acetamide Traditional Name: 2-(2-ketoazepan-1-yl)-N-(4-methyl-3-piperidinosulfonyl-phenyl)acetamide Formula: C20H29N3O4S MolecularWeight: 407.52696

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)CN2CCCCCC2=O)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)CN2CCCCCC2=O)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C20H29N3O4S/c1-16-9-10-17(14-18(16)28(26,27)23-12-6-3-7-13-23)21-19(24)15-22-11-5-2-4-8-20(22)25/h9-10,14H,2-8,11-13,15H2,1H3,(H,21,24)