10-methylacridin-10-ium-3,6-diamine sulfate

Systemtic Name: 10-methylacridin-10-ium-3,6-diamine sulfate Openeye Name: 10-methylacridin-10-ium-3,6-diamine sulfate CAS Name: 10-methylacridin-10-ium-3,6-diamine sulfate IUPAC Name: 10-methylacridin-10-ium-3,6-diamine sulfate Traditional Name: (6-amino-10-methyl-acridin-10-ium-3-yl)amine sulfate Formula: C28H28N6O4S MolecularWeight: 544.62472

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C2C=C(C=CC2=CC3=C1C=C(C=C3)N)N.C[N+]1=C2C=C(C=CC2=CC3=C1C=C(C=C3)N)N.[O-]S(=O)(=O)[O-]

Isomeric SMILES

C[N+]1=C2C=C(C=CC2=CC3=C1C=C(C=C3)N)N.C[N+]1=C2C=C(C=CC2=CC3=C1C=C(C=C3)N)N.[O-]S(=O)(=O)[O-]

InChI

InChI=1S/2C14H13N3.H2O4S/c2*1-17-13-7-11(15)4-2-9(13)6-10-3-5-12(16)8-14(10)17;1-5(2,3)4/h2*2-8H,1H3,(H3,15,16);(H2,1,2,3,4)