2-[(Z)-C-(4-methoxyphenyl)carbonyl-N-oxidanyl-carbonimidoyl]sulfanylethyl-trimethyl-azanium

Systemtic Name: 2-[(Z)-C-(4-methoxyphenyl)carbonyl-N-oxidanyl-carbonimidoyl]sulfanylethyl-trimethyl-azanium Openeye Name: 2-[(Z)-N-hydroxy-C-(4-methoxybenzoyl)carbonimidoyl]sulfanylethyl-trimethyl-ammonium CAS Name: 2-[[(1Z)-1-hydroxyimino-2-(4-methoxyphenyl)-2-oxoethyl]thio]ethyl-trimethylammonium IUPAC Name: 2-[(Z)-N-hydroxy-C-(4-methoxybenzoyl)carbonimidoyl]sulfanylethyl-trimethylazanium Traditional Name: 2-[[2-keto-2-(4-methoxyphenyl)acetohydroximoyl]thio]ethyl-trimethyl-ammonium Formula: C14H21N2O3S+ MolecularWeight: 297.39314

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)CCSC(=NO)C(=O)C1=CC=C(C=C1)OC

Isomeric SMILES

C[N+](C)(C)CCS/C(=N\O)/C(=O)C1=CC=C(C=C1)OC

InChI

InChI=1S/C14H20N2O3S/c1-16(2,3)9-10-20-14(15-18)13(17)11-5-7-12(19-4)8-6-11/h5-8H,9-10H2,1-4H3/p+1