2-(aminocarbamoylamino)-6-azanyl-1,3-bis(oxidanylidene)benzo[de]isoquinoline-5,8-disulfonic acid

Systemtic Name: 2-(aminocarbamoylamino)-6-azanyl-1,3-bis(oxidanylidene)benzo[de]isoquinoline-5,8-disulfonic acid Openeye Name: 6-amino-2-(hydrazinecarbonylamino)-1,3-dioxo-benzo[de]isoquinoline-5,8-disulfonic acid CAS Name: 6-amino-2-(hydrazinecarbonylamino)-1,3-dioxobenzo[de]isoquinoline-5,8-disulfonic acid IUPAC Name: 6-amino-2-(hydrazinecarbonylamino)-1,3-dioxobenzo[de]isoquinoline-5,8-disulfonic acid Traditional Name: 6-amino-2-(carbazoylamino)-1,3-diketo-benzo[de]isoquinoline-5,8-disulfonic acid Formula: C13H11N5O9S2 MolecularWeight: 445.38454

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C2C3=C1C(=O)N(C(=O)C3=CC(=C2N)S(=O)(=O)O)NC(=O)NN)S(=O)(=O)O

Isomeric SMILES

C1=C(C=C2C3=C1C(=O)N(C(=O)C3=CC(=C2N)S(=O)(=O)O)NC(=O)NN)S(=O)(=O)O

InChI

InChI=1S/C13H11N5O9S2/c14-10-5-1-4(28(22,23)24)2-6-9(5)7(3-8(10)29(25,26)27)12(20)18(11(6)19)17-13(21)16-15/h1-3H,14-15H2,(H2,16,17,21)(H,22,23,24)(H,25,26,27)