N-heptan-2-yl-4-methylsulfonyl-butanamide hydrochloride

Systemtic Name: N-heptan-2-yl-4-methylsulfonyl-butanamide hydrochloride Openeye Name: N-(1-methylhexyl)-4-methylsulfonyl-butanamide hydrochloride CAS Name: N-heptan-2-yl-4-methylsulfonylbutanamide hydrochloride IUPAC Name: N-heptan-2-yl-4-methylsulfonylbutanamide hydrochloride Traditional Name: 4-mesyl-N-(1-methylhexyl)butyramide hydrochloride Formula: C12H26ClNO3S MolecularWeight: 299.85774

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)NC(=O)CCCS(=O)(=O)C.Cl

Isomeric SMILES

CCCCCC(C)NC(=O)CCCS(=O)(=O)C.Cl

InChI

InChI=1S/C12H25NO3S.ClH/c1-4-5-6-8-11(2)13-12(14)9-7-10-17(3,15)16;/h11H,4-10H2,1-3H3,(H,13,14);1H