[(3S,4R)-4-(4-methoxy-3-methyl-phenyl)sulfonyl-1,1-bis(oxidanylidene)thiolan-3-yl]-pentyl-azanium

Systemtic Name: [(3S,4R)-4-(4-methoxy-3-methyl-phenyl)sulfonyl-1,1-bis(oxidanylidene)thiolan-3-yl]-pentyl-azanium Openeye Name: [(3S,4R)-4-(4-methoxy-3-methyl-phenyl)sulfonyl-1,1-dioxo-thiolan-3-yl]-pentyl-ammonium CAS Name: [(3S,4R)-4-(4-methoxy-3-methylphenyl)sulfonyl-1,1-dioxo-3-thiolanyl]-pentylammonium IUPAC Name: [(3S,4R)-4-(4-methoxy-3-methylphenyl)sulfonyl-1,1-dioxothiolan-3-yl]-pentylazanium Traditional Name: amyl-[(3S,4R)-1,1-diketo-4-(4-methoxy-3-methyl-phenyl)sulfonyl-thiolan-3-yl]ammonium Formula: C17H28NO5S2+ MolecularWeight: 390.53792

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC[NH2+]C1CS(=O)(=O)CC1S(=O)(=O)C2=CC(=C(C=C2)OC)C

Isomeric SMILES

CCCCC[NH2+][C@H]1CS(=O)(=O)C[C@@H]1S(=O)(=O)C2=CC(=C(C=C2)OC)C

InChI

InChI=1S/C17H27NO5S2/c1-4-5-6-9-18-15-11-24(19,20)12-17(15)25(21,22)14-7-8-16(23-3)13(2)10-14/h7-8,10,15,17-18H,4-6,9,11-12H2,1-3H3/p+1/t15-,17-/m0/s1