(Z)-1-[butyl-(4-methoxyphenyl)amino]-2-diazonio-2-(phenylsulfonyl)ethenolate

Systemtic Name: (Z)-1-[butyl-(4-methoxyphenyl)amino]-2-diazonio-2-(phenylsulfonyl)ethenolate Openeye Name: (Z)-2-(benzenesulfonyl)-1-(N-butyl-4-methoxy-anilino)-2-diazonio-ethenolate CAS Name: (Z)-2-(benzenesulfonyl)-1-(N-butyl-4-methoxyanilino)-2-diazonioethenolate IUPAC Name: (Z)-2-(benzenesulfonyl)-1-(N-butyl-4-methoxyanilino)-2-diazonioethenolate Traditional Name: (Z)-2-besyl-1-(N-butyl-4-methoxy-anilino)-2-diazonio-ethenolate Formula: C19H21N3O4S MolecularWeight: 387.45274

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C1=CC=C(C=C1)OC)C(=C([N+]#N)S(=O)(=O)C2=CC=CC=C2)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C19H21N3O4S/c1-3-4-14-22(15-10-12-16(26-2)13-11-15)19(23)18(21-20)27(24,25)17-8-6-5-7-9-17/h5-13H,3-4,14H2,1-2H3/b19-18-