(Z)-2-diazonio-1-ethoxy-4-methyl-5-[(4-methylphenyl)sulfonylamino]-3-oxidanylidene-5-phenyl-pent-1-en-1-olate

Systemtic Name: (Z)-2-diazonio-1-ethoxy-4-methyl-5-[(4-methylphenyl)sulfonylamino]-3-oxidanylidene-5-phenyl-pent-1-en-1-olate Openeye Name: (Z)-2-diazonio-1-ethoxy-4-methyl-3-oxo-5-phenyl-5-(p-tolylsulfonylamino)pent-1-en-1-olate CAS Name: (Z)-2-diazonio-1-ethoxy-4-methyl-5-[(4-methylphenyl)sulfonylamino]-3-oxo-5-phenyl-1-penten-1-olate IUPAC Name: (Z)-2-diazonio-1-ethoxy-4-methyl-5-[(4-methylphenyl)sulfonylamino]-3-oxo-5-phenylpent-1-en-1-olate Traditional Name: (Z)-2-diazonio-1-ethoxy-3-keto-4-methyl-5-phenyl-5-(tosylamino)pent-1-en-1-olate Formula: C21H23N3O5S MolecularWeight: 429.48942

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=C(C(=O)C(C)C(C1=CC=CC=C1)NS(=O)(=O)C2=CC=C(C=C2)C)[N+]#N)[O-]

Isomeric SMILES

CCO/C(=C(/C(=O)C(C)C(C1=CC=CC=C1)NS(=O)(=O)C2=CC=C(C=C2)C)\[N+]#N)/[O-]

InChI

InChI=1S/C21H23N3O5S/c1-4-29-21(26)19(23-22)20(25)15(3)18(16-8-6-5-7-9-16)24-30(27,28)17-12-10-14(2)11-13-17/h5-13,15,18,24H,4H2,1-3H3