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

Systemtic Name: 2-(3-aminophenyl)-6-azanyl-1,3-bis(oxidanylidene)benzo[de]isoquinoline-5,8-disulfinic acid Openeye Name: 6-amino-2-(3-aminophenyl)-1,3-dioxo-benzo[de]isoquinoline-5,8-disulfinic acid CAS Name: 6-amino-2-(3-aminophenyl)-1,3-dioxobenzo[de]isoquinoline-5,8-disulfinic acid IUPAC Name: 6-amino-2-(3-aminophenyl)-1,3-dioxobenzo[de]isoquinoline-5,8-disulfinic acid Traditional Name: 6-amino-2-(3-aminophenyl)-1,3-diketo-benzo[de]isoquinoline-5,8-disulfinic acid Formula: C18H13N3O6S2 MolecularWeight: 431.44232

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)N)N2C(=O)C3=CC(=C(C4=CC(=CC(=C43)C2=O)S(=O)O)N)S(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)N)N2C(=O)C3=CC(=C(C4=CC(=CC(=C43)C2=O)S(=O)O)N)S(=O)O

InChI

InChI=1S/C18H13N3O6S2/c19-8-2-1-3-9(4-8)21-17(22)12-6-10(28(24)25)5-11-15(12)13(18(21)23)7-14(16(11)20)29(26)27/h1-7H,19-20H2,(H,24,25)(H,26,27)