methyl-(4-oxidanylidene-4-propan-2-yloxy-2-propan-2-yloxycarbonyl-butanethioyl)-phenyl-sulfanyl-azanium

Systemtic Name: methyl-(4-oxidanylidene-4-propan-2-yloxy-2-propan-2-yloxycarbonyl-butanethioyl)-phenyl-sulfanyl-azanium Openeye Name: (4-isopropoxy-2-isopropoxycarbonyl-4-oxo-butanethioyl)-methyl-phenyl-sulfanyl-ammonium CAS Name: mercapto-methyl-[4-oxo-2-[oxo(propan-2-yloxy)methyl]-4-propan-2-yloxy-1-sulfanylidenebutyl]-phenylammonium IUPAC Name: methyl-(4-oxo-4-propan-2-yloxy-2-propan-2-yloxycarbonylbutanethioyl)-phenyl-sulfanylazanium Traditional Name: (4-isopropoxy-2-isopropoxycarbonyl-4-keto-butanethioyl)-mercapto-methyl-phenyl-ammonium Formula: C18H26NO4S2+ MolecularWeight: 384.53334

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)CC(C(=S)[N+](C)(C1=CC=CC=C1)S)C(=O)OC(C)C

Isomeric SMILES

CC(C)OC(=O)CC(C(=S)[N+](C)(C1=CC=CC=C1)S)C(=O)OC(C)C

InChI

InChI=1S/C18H26NO4S2/c1-12(2)22-16(20)11-15(18(21)23-13(3)4)17(24)19(5,25)14-9-7-6-8-10-14/h6-10,12-13,15,25H,11H2,1-5H3/q+1