(Z)-2-diazonio-1-methoxy-2-[2-[3-[(4-methylphenyl)sulfonylamino]-3-oxidanylidene-propyl]phenyl]ethenolate

Systemtic Name: (Z)-2-diazonio-1-methoxy-2-[2-[3-[(4-methylphenyl)sulfonylamino]-3-oxidanylidene-propyl]phenyl]ethenolate Openeye Name: (Z)-2-diazonio-1-methoxy-2-[2-[3-oxo-3-(p-tolylsulfonylamino)propyl]phenyl]ethenolate CAS Name: (Z)-2-diazonio-1-methoxy-2-[2-[3-[(4-methylphenyl)sulfonylamino]-3-oxopropyl]phenyl]ethenolate IUPAC Name: (Z)-2-diazonio-1-methoxy-2-[2-[3-[(4-methylphenyl)sulfonylamino]-3-oxopropyl]phenyl]ethenolate Traditional Name: (Z)-2-diazonio-2-[2-[3-keto-3-(tosylamino)propyl]phenyl]-1-methoxy-ethenolate Formula: C19H19N3O5S MolecularWeight: 401.43626

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(=O)CCC2=CC=CC=C2C(=C([O-])OC)[N+]#N

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(=O)CCC2=CC=CC=C2/C(=C(\[O-])/OC)/[N+]#N

InChI

InChI=1S/C19H19N3O5S/c1-13-7-10-15(11-8-13)28(25,26)22-17(23)12-9-14-5-3-4-6-16(14)18(21-20)19(24)27-2/h3-8,10-11H,9,12H2,1-2H3,(H-,22,23,24)/b19-18-