disodium 1-azanyl-9,10-bis(oxidanylidene)-4-[(5-sulfonatonaphthalen-1-yl)amino]anthracene-2-sulfonate

Systemtic Name: disodium 1-azanyl-9,10-bis(oxidanylidene)-4-[(5-sulfonatonaphthalen-1-yl)amino]anthracene-2-sulfonate Openeye Name: disodium 1-amino-9,10-dioxo-4-[(5-sulfonato-1-naphthyl)amino]anthracene-2-sulfonate CAS Name: disodium 1-amino-9,10-dioxo-4-[(5-sulfonato-1-naphthalenyl)amino]-2-anthracenesulfonate IUPAC Name: disodium 1-amino-9,10-dioxo-4-[(5-sulfonatonaphthalen-1-yl)amino]anthracene-2-sulfonate Traditional Name: disodium 1-amino-9,10-diketo-4-[(5-sulfonato-1-naphthyl)amino]anthracene-2-sulfonate Formula: C24H14N2Na2O8S2 MolecularWeight: 568.4861

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=C(C=C3NC4=CC=CC5=C4C=CC=C5S(=O)(=O)[O-])S(=O)(=O)[O-])N.[Na+].[Na+]

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=C(C=C3NC4=CC=CC5=C4C=CC=C5S(=O)(=O)[O-])S(=O)(=O)[O-])N.[Na+].[Na+]

InChI

InChI=1S/C24H16N2O8S2.2Na/c25-22-19(36(32,33)34)11-17(20-21(22)24(28)15-6-2-1-5-14(15)23(20)27)26-16-9-3-8-13-12(16)7-4-10-18(13)35(29,30)31;;/h1-11,26H,25H2,(H,29,30,31)(H,32,33,34);;/q;2*+1/p-2