[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-methyl-[(4-methyl-2-oxidanyl-5-propan-2-yl-phenyl)methyl]azanium

Systemtic Name: [(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-methyl-[(4-methyl-2-oxidanyl-5-propan-2-yl-phenyl)methyl]azanium Openeye Name: [(3S)-1,1-dioxothiolan-3-yl]-[(2-hydroxy-5-isopropyl-4-methyl-phenyl)methyl]-methyl-ammonium CAS Name: [(3S)-1,1-dioxo-3-thiolanyl]-[(2-hydroxy-4-methyl-5-propan-2-ylphenyl)methyl]-methylammonium IUPAC Name: [(3S)-1,1-dioxothiolan-3-yl]-[(2-hydroxy-4-methyl-5-propan-2-ylphenyl)methyl]-methylazanium Traditional Name: [(3S)-1,1-diketothiolan-3-yl]-(2-hydroxy-5-isopropyl-4-methyl-benzyl)-methyl-ammonium Formula: C16H26NO3S+ MolecularWeight: 312.44754

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C(C)C)C[NH+](C)C2CCS(=O)(=O)C2)O

Isomeric SMILES

CC1=CC(=C(C=C1C(C)C)C[NH+](C)[C@H]2CCS(=O)(=O)C2)O

InChI

InChI=1S/C16H25NO3S/c1-11(2)15-8-13(16(18)7-12(15)3)9-17(4)14-5-6-21(19,20)10-14/h7-8,11,14,18H,5-6,9-10H2,1-4H3/p+1/t14-/m0/s1