Molecule ID: 93367

IUPAC Name: dilithium;6-amino-2-(hydrazinecarbonylamino)-1,3-dioxobenzo[de]isoquinoline-5,8-disulfonate

Description: The molecule is an organic dilithium salt having 6-amino-2-[(hydrazinocarbonyl)amino]-1,3-dioxo-2,3-dihydro-1H-benzo[de]isoquinoline-5,8-disulfonate as the counterion. It has a role as a fluorochrome. It contains a lucifer yellow carbohydrazide dye(2-).

SMILES: NN=C([O-])NN1C(=O)c2cc(S(=O)(=O)[O-])cc3c(N)c(S(=O)(=O)O)cc(c23)C1=O.[Li+].[Li+]

SELFIES: [N][N][=C][Branch1][C][O-1][N][N][C][=Branch1][C][=O][C][=C][C][Branch1][=Branch2][S][=Branch1][C][=O][=Branch1][C][=O][O-1][=C][C][=C][Branch1][C][N][C][Branch1][=Branch2][S][=Branch1][C][=O][=Branch1][C][=O][O][=C][C][=Branch1][#Branch1][=C][Ring2][Ring1][Ring1][Ring1][O][C][Ring2][Ring1][#Branch1][=O].[Li+1].[Li+1]

InChI: InChI=1S/C13H11N5O9S2.2Li/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);;/q;2*+1/p-2

Molecular Properties:
- Polar Surface Area: 262.0 Ų
- LogP: nan