dimethyl (6E)-4-azanyl-6-(methylhydrazinylidene)-3-[(2-methylphenyl)diazenyl]-5-oxidanylidene-naphthalene-1,7-disulfonate

Systemtic Name: dimethyl (6E)-4-azanyl-6-(methylhydrazinylidene)-3-[(2-methylphenyl)diazenyl]-5-oxidanylidene-naphthalene-1,7-disulfonate Openeye Name: dimethyl (6E)-4-amino-6-(methylhydrazono)-3-(o-tolylazo)-5-oxo-naphthalene-1,7-disulfonate CAS Name: (6E)-4-amino-6-(methylhydrazinylidene)-3-(2-methylphenyl)azo-5-oxonaphthalene-1,7-disulfonic acid dimethyl ester IUPAC Name: dimethyl (6E)-4-amino-6-(methylhydrazinylidene)-3-[(2-methylphenyl)diazenyl]-5-oxonaphthalene-1,7-disulfonate Traditional Name: (6E)-4-amino-5-keto-6-(methylhydrazono)-3-(o-tolylazo)naphthalene-1,7-disulfonic acid dimethyl ester Formula: C20H21N5O7S2 MolecularWeight: 507.54004

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N=NC2=CC(=C3C=C(C(=NNC)C(=O)C3=C2N)S(=O)(=O)OC)S(=O)(=O)OC

Isomeric SMILES

CC1=CC=CC=C1N=NC2=CC(=C3C=C(/C(=N/NC)/C(=O)C3=C2N)S(=O)(=O)OC)S(=O)(=O)OC

InChI

InChI=1S/C20H21N5O7S2/c1-11-7-5-6-8-13(11)23-24-14-10-15(33(27,28)31-3)12-9-16(34(29,30)32-4)19(25-22-2)20(26)17(12)18(14)21/h5-10,22H,21H2,1-4H3/b24-23?,25-19-