(Z)-4-diazonio-1-(4-morpholin-4-ylsulfonylphenyl)-5-oxidanylidene-hex-3-en-3-olate

Systemtic Name: (Z)-4-diazonio-1-(4-morpholin-4-ylsulfonylphenyl)-5-oxidanylidene-hex-3-en-3-olate Openeye Name: (Z)-4-diazonio-1-(4-morpholinosulfonylphenyl)-5-oxo-hex-3-en-3-olate CAS Name: (Z)-4-diazonio-1-[4-(4-morpholinylsulfonyl)phenyl]-5-oxo-3-hexen-3-olate IUPAC Name: (Z)-4-diazonio-1-(4-morpholin-4-ylsulfonylphenyl)-5-oxohex-3-en-3-olate Traditional Name: (Z)-4-diazonio-5-keto-1-(4-morpholinosulfonylphenyl)hex-3-en-3-olate Formula: C16H19N3O5S MolecularWeight: 365.40416

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(=C(CCC1=CC=C(C=C1)S(=O)(=O)N2CCOCC2)[O-])[N+]#N

Isomeric SMILES

CC(=O)/C(=C(\CCC1=CC=C(C=C1)S(=O)(=O)N2CCOCC2)/[O-])/[N+]#N

InChI

InChI=1S/C16H19N3O5S/c1-12(20)16(18-17)15(21)7-4-13-2-5-14(6-3-13)25(22,23)19-8-10-24-11-9-19/h2-3,5-6H,4,7-11H2,1H3