disodium 4-oxidanyl-5-[[(Z)-(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)methyl]amino]naphthalene-2,7-disulfonate

Systemtic Name: disodium 4-oxidanyl-5-[[(Z)-(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)methyl]amino]naphthalene-2,7-disulfonate Openeye Name: disodium 4-hydroxy-5-[[(Z)-(6-oxocyclohexa-2,4-dien-1-ylidene)methyl]amino]naphthalene-2,7-disulfonate CAS Name: disodium 4-hydroxy-5-[[(Z)-(6-oxo-1-cyclohexa-2,4-dienylidene)methyl]amino]naphthalene-2,7-disulfonate IUPAC Name: disodium 4-hydroxy-5-[[(Z)-(6-oxocyclohexa-2,4-dien-1-ylidene)methyl]amino]naphthalene-2,7-disulfonate Traditional Name: disodium 4-hydroxy-5-[[(Z)-(6-ketocyclohexa-2,4-dien-1-ylidene)methyl]amino]naphthalene-2,7-disulfonate Formula: C17H11NNa2O8S2 MolecularWeight: 467.38068

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CNC2=C3C(=CC(=C2)S(=O)(=O)[O-])C=C(C=C3O)S(=O)(=O)[O-])C(=O)C=C1.[Na+].[Na+]

Isomeric SMILES

C1=C/C(=C/NC2=C3C(=CC(=C2)S(=O)(=O)[O-])C=C(C=C3O)S(=O)(=O)[O-])/C(=O)C=C1.[Na+].[Na+]

InChI

InChI=1S/C17H13NO8S2.2Na/c19-15-4-2-1-3-10(15)9-18-14-7-12(27(21,22)23)5-11-6-13(28(24,25)26)8-16(20)17(11)14;;/h1-9,18,20H,(H,21,22,23)(H,24,25,26);;/q;2*+1/p-2/b10-9-;;