disodium (3Z)-7-azanyl-3-[[3-methyl-4-[(4-sulfonatophenyl)diazenyl]phenyl]hydrazinylidene]-4-oxidanylidene-naphthalene-2-sulfonate

Systemtic Name: disodium (3Z)-7-azanyl-3-[[3-methyl-4-[(4-sulfonatophenyl)diazenyl]phenyl]hydrazinylidene]-4-oxidanylidene-naphthalene-2-sulfonate Openeye Name: disodium (3Z)-7-amino-3-[[3-methyl-4-(4-sulfonatophenyl)azo-phenyl]hydrazono]-4-oxo-naphthalene-2-sulfonate CAS Name: disodium (3Z)-7-amino-3-[[3-methyl-4-(4-sulfonatophenyl)azophenyl]hydrazinylidene]-4-oxo-2-naphthalenesulfonate IUPAC Name: disodium (3Z)-7-amino-3-[[3-methyl-4-[(4-sulfonatophenyl)diazenyl]phenyl]hydrazinylidene]-4-oxonaphthalene-2-sulfonate Traditional Name: disodium (3Z)-7-amino-4-keto-3-[[3-methyl-4-(4-sulfonatophenyl)azo-phenyl]hydrazono]naphthalene-2-sulfonate Formula: C23H17N5Na2O7S2 MolecularWeight: 585.51992

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NN=C2C(=CC3=C(C2=O)C=CC(=C3)N)S(=O)(=O)[O-])N=NC4=CC=C(C=C4)S(=O)(=O)[O-].[Na+].[Na+]

Isomeric SMILES

CC1=C(C=CC(=C1)N/N=C/2\C(=CC3=C(C2=O)C=CC(=C3)N)S(=O)(=O)[O-])N=NC4=CC=C(C=C4)S(=O)(=O)[O-].[Na+].[Na+]

InChI

InChI=1S/C23H19N5O7S2.2Na/c1-13-10-17(5-9-20(13)27-25-16-3-6-18(7-4-16)36(30,31)32)26-28-22-21(37(33,34)35)12-14-11-15(24)2-8-19(14)23(22)29;;/h2-12,26H,24H2,1H3,(H,30,31,32)(H,33,34,35);;/q;2*+1/p-2/b27-25?,28-22+;;