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

Systemtic Name: butyl-[(3S,4R)-4-(4-ethoxyphenyl)sulfonyl-1,1-bis(oxidanylidene)thiolan-3-yl]azanium Openeye Name: butyl-[(3S,4R)-4-(4-ethoxyphenyl)sulfonyl-1,1-dioxo-thiolan-3-yl]ammonium CAS Name: butyl-[(3S,4R)-4-(4-ethoxyphenyl)sulfonyl-1,1-dioxo-3-thiolanyl]ammonium IUPAC Name: butyl-[(3S,4R)-4-(4-ethoxyphenyl)sulfonyl-1,1-dioxothiolan-3-yl]azanium Traditional Name: butyl-[(3S,4R)-1,1-diketo-4-p-phenetylsulfonyl-thiolan-3-yl]ammonium Formula: C16H26NO5S2+ MolecularWeight: 376.51134

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[NH2+]C1CS(=O)(=O)CC1S(=O)(=O)C2=CC=C(C=C2)OCC

Isomeric SMILES

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

InChI

InChI=1S/C16H25NO5S2/c1-3-5-10-17-15-11-23(18,19)12-16(15)24(20,21)14-8-6-13(7-9-14)22-4-2/h6-9,15-17H,3-5,10-12H2,1-2H3/p+1/t15-,16-/m0/s1