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

Systemtic Name: 3-azido-10-methyl-acridin-10-ium; methyl sulfate Openeye Name: 3-azido-10-methyl-acridin-10-ium; methyl sulfate CAS Name: 3-azido-10-methylacridin-10-ium; methyl sulfate IUPAC Name: 3-azido-10-methylacridin-10-ium; methyl sulfate Traditional Name: 3-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=C(C=CC2=CC3=CC=CC=C31)N=[N+]=[N-].COS(=O)(=O)[O-]

Isomeric SMILES

C[N+]1=C2C=C(C=CC2=CC3=CC=CC=C31)N=[N+]=[N-].COS(=O)(=O)[O-]

InChI

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