3-methylbutyl-[(3S,4R)-4-(4-methylphenyl)sulfonyl-1,1-bis(oxidanylidene)thiolan-3-yl]azanium

Systemtic Name: 3-methylbutyl-[(3S,4R)-4-(4-methylphenyl)sulfonyl-1,1-bis(oxidanylidene)thiolan-3-yl]azanium Openeye Name: [(3S,4R)-1,1-dioxo-4-(p-tolylsulfonyl)thiolan-3-yl]-isopentyl-ammonium CAS Name: 3-methylbutyl-[(3S,4R)-4-(4-methylphenyl)sulfonyl-1,1-dioxo-3-thiolanyl]ammonium IUPAC Name: 3-methylbutyl-[(3S,4R)-4-(4-methylphenyl)sulfonyl-1,1-dioxothiolan-3-yl]azanium Traditional Name: [(3S,4R)-1,1-diketo-4-tosyl-thiolan-3-yl]-isoamyl-ammonium Formula: C16H26NO4S2+ MolecularWeight: 360.51194

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C2CS(=O)(=O)CC2[NH2+]CCC(C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)[C@H]2CS(=O)(=O)C[C@@H]2[NH2+]CCC(C)C

InChI

InChI=1S/C16H25NO4S2/c1-12(2)8-9-17-15-10-22(18,19)11-16(15)23(20,21)14-6-4-13(3)5-7-14/h4-7,12,15-17H,8-11H2,1-3H3/p+1/t15-,16-/m0/s1