trisodium (3Z)-5-azanyl-4-oxidanylidene-3-[(2-sulfonatophenyl)hydrazinylidene]naphthalene-2,7-disulfonate

Systemtic Name: trisodium (3Z)-5-azanyl-4-oxidanylidene-3-[(2-sulfonatophenyl)hydrazinylidene]naphthalene-2,7-disulfonate Openeye Name: trisodium (3Z)-5-amino-4-oxo-3-[(2-sulfonatophenyl)hydrazono]naphthalene-2,7-disulfonate CAS Name: trisodium (3Z)-5-amino-4-oxo-3-[(2-sulfonatophenyl)hydrazinylidene]naphthalene-2,7-disulfonate IUPAC Name: trisodium (3Z)-5-amino-4-oxo-3-[(2-sulfonatophenyl)hydrazinylidene]naphthalene-2,7-disulfonate Traditional Name: trisodium (3Z)-5-amino-4-keto-3-[(2-sulfonatophenyl)hydrazono]naphthalene-2,7-disulfonate Formula: C16H10N3Na3O10S3 MolecularWeight: 569.42901

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)NN=C2C(=CC3=CC(=CC(=C3C2=O)N)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+]

Isomeric SMILES

C1=CC=C(C(=C1)N/N=C/2\C(=CC3=CC(=CC(=C3C2=O)N)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+]

InChI

InChI=1S/C16H13N3O10S3.3Na/c17-10-7-9(30(21,22)23)5-8-6-13(32(27,28)29)15(16(20)14(8)10)19-18-11-3-1-2-4-12(11)31(24,25)26;;;/h1-7,18H,17H2,(H,21,22,23)(H,24,25,26)(H,27,28,29);;;/q;3*+1/p-3/b19-15+;;;