7-[7-azanyl-2,3-bis(oxidanylidene)-4H-quinoxalin-1-yl]naphthalene-1,3-disulfonic acid

Systemtic Name: 7-[7-azanyl-2,3-bis(oxidanylidene)-4H-quinoxalin-1-yl]naphthalene-1,3-disulfonic acid Openeye Name: 7-(7-amino-2,3-dioxo-4H-quinoxalin-1-yl)naphthalene-1,3-disulfonic acid CAS Name: 7-(7-amino-2,3-dioxo-4H-quinoxalin-1-yl)naphthalene-1,3-disulfonic acid IUPAC Name: 7-(7-amino-2,3-dioxo-4H-quinoxalin-1-yl)naphthalene-1,3-disulfonic acid Traditional Name: 7-(7-amino-2,3-diketo-4H-quinoxalin-1-yl)naphthalene-1,3-disulfonic acid Formula: C18H13N3O8S2 MolecularWeight: 463.44112

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC2=C(C=C(C=C21)S(=O)(=O)O)S(=O)(=O)O)N3C4=C(C=CC(=C4)N)NC(=O)C3=O

Isomeric SMILES

C1=CC(=CC2=C(C=C(C=C21)S(=O)(=O)O)S(=O)(=O)O)N3C4=C(C=CC(=C4)N)NC(=O)C3=O

InChI

InChI=1S/C18H13N3O8S2/c19-10-2-4-14-15(6-10)21(18(23)17(22)20-14)11-3-1-9-5-12(30(24,25)26)8-16(13(9)7-11)31(27,28)29/h1-8H,19H2,(H,20,22)(H,24,25,26)(H,27,28,29)