disodium 6-(4-aminophenyl)-3-azanyl-cyclohexa-2,4-diene-1,1-disulfonate

Systemtic Name: disodium 6-(4-aminophenyl)-3-azanyl-cyclohexa-2,4-diene-1,1-disulfonate Openeye Name: disodium 3-amino-6-(4-aminophenyl)cyclohexa-2,4-diene-1,1-disulfonate CAS Name: disodium 3-amino-6-(4-aminophenyl)cyclohexa-2,4-diene-1,1-disulfonate IUPAC Name: disodium 3-amino-6-(4-aminophenyl)cyclohexa-2,4-diene-1,1-disulfonate Traditional Name: disodium 3-amino-6-(4-aminophenyl)cyclohexa-2,4-diene-1,1-disulfonate Formula: C12H12N2Na2O6S2 MolecularWeight: 390.34302

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(C1C2=CC=C(C=C2)N)(S(=O)(=O)[O-])S(=O)(=O)[O-])N.[Na+].[Na+]

Isomeric SMILES

C1=CC(=CC(C1C2=CC=C(C=C2)N)(S(=O)(=O)[O-])S(=O)(=O)[O-])N.[Na+].[Na+]

InChI

InChI=1S/C12H14N2O6S2.2Na/c13-9-3-1-8(2-4-9)11-6-5-10(14)7-12(11,21(15,16)17)22(18,19)20;;/h1-7,11H,13-14H2,(H,15,16,17)(H,18,19,20);;/q;2*+1/p-2