sodium [4-[2-[2,3-bis(oxidanylidene)naphthalen-1-yl]hydrazinyl]-7-nitro-3-oxidanyl-naphthalen-1-yl] sulfate

Systemtic Name: sodium [4-[2-[2,3-bis(oxidanylidene)naphthalen-1-yl]hydrazinyl]-7-nitro-3-oxidanyl-naphthalen-1-yl] sulfate Openeye Name: sodium [4-[2-(2,3-dioxo-1-naphthyl)hydrazino]-3-hydroxy-7-nitro-1-naphthyl] sulfate CAS Name: sodium [4-[(2,3-dioxo-1-naphthalenyl)hydrazo]-3-hydroxy-7-nitro-1-naphthalenyl] sulfate IUPAC Name: sodium [4-[2-(2,3-dioxonaphthalen-1-yl)hydrazinyl]-3-hydroxy-7-nitronaphthalen-1-yl] sulfate Traditional Name: sodium [4-[N'-(2,3-diketo-1-naphthyl)hydrazino]-3-hydroxy-7-nitro-1-naphthyl] sulfate Formula: C20H12N3NaO9S MolecularWeight: 493.37875

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=CC(=O)C(=O)C(=C2C=C1)NNC3=C(C=C(C4=C3C=CC(=C4)[N+](=O)[O-])OS(=O)(=O)[O-])O.[Na+]

Isomeric SMILES

C1=CC2=CC(=O)C(=O)C(=C2C=C1)NNC3=C(C=C(C4=C3C=CC(=C4)[N+](=O)[O-])OS(=O)(=O)[O-])O.[Na+]

InChI

InChI=1S/C20H13N3O9S.Na/c24-15-9-17(32-33(29,30)31)14-8-11(23(27)28)5-6-13(14)18(15)21-22-19-12-4-2-1-3-10(12)7-16(25)20(19)26;/h1-9,21-22,24H,(H,29,30,31);/q;+1/p-1