9-azido-10-methyl-acridin-10-ium; methyl sulfate

Systemtic Name: 9-azido-10-methyl-acridin-10-ium; methyl sulfate Openeye Name: 9-azido-10-methyl-acridin-10-ium; methyl sulfate CAS Name: 9-azido-10-methylacridin-10-ium; methyl sulfate IUPAC Name: 9-azido-10-methylacridin-10-ium; methyl sulfate Traditional Name: 9-azido-10-methyl-acridin-10-ium; methyl sulfate Formula: C15H14N4O4S MolecularWeight: 346.36106

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C2C=CC=CC2=C(C3=CC=CC=C31)N=[N+]=[N-].COS(=O)(=O)[O-]

Isomeric SMILES

C[N+]1=C2C=CC=CC2=C(C3=CC=CC=C31)N=[N+]=[N-].COS(=O)(=O)[O-]

InChI

InChI=1S/C14H11N4.CH4O4S/c1-18-12-8-4-2-6-10(12)14(16-17-15)11-7-3-5-9-13(11)18;1-5-6(2,3)4/h2-9H,1H3;1H3,(H,2,3,4)/q+1;/p-1