acridine-3,6-diamine sulfate dihydrate

Systemtic Name: acridine-3,6-diamine sulfate dihydrate Openeye Name: acridine-3,6-diamine sulfate dihydrate CAS Name: acridine-3,6-diamine sulfate dihydrate IUPAC Name: acridine-3,6-diamine sulfate dihydrate Traditional Name: (6-aminoacridin-3-yl)amine sulfate dihydrate Formula: C26H26N6O6S-2 MolecularWeight: 550.58624

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC2=NC3=C(C=CC(=C3)N)C=C21)N.C1=CC(=CC2=NC3=C(C=CC(=C3)N)C=C21)N.O.O.[O-]S(=O)(=O)[O-]

Isomeric SMILES

C1=CC(=CC2=NC3=C(C=CC(=C3)N)C=C21)N.C1=CC(=CC2=NC3=C(C=CC(=C3)N)C=C21)N.O.O.[O-]S(=O)(=O)[O-]

InChI

InChI=1S/2C13H11N3.H2O4S.2H2O/c2*14-10-3-1-8-5-9-2-4-11(15)7-13(9)16-12(8)6-10;1-5(2,3)4;;/h2*1-7H,14-15H2;(H2,1,2,3,4);2*1H2/p-2