3-nitro-[1,3]benzothiazolo[3,2-a]quinolin-12-ium perchlorate

Systemtic Name: 3-nitro-[1,3]benzothiazolo[3,2-a]quinolin-12-ium perchlorate Openeye Name: 3-nitro-[1,3]benzothiazolo[3,2-a]quinolin-12-ium perchlorate CAS Name: 3-nitro-[1,3]benzothiazolo[3,2-a]quinolin-12-ium perchlorate IUPAC Name: 3-nitro-[1,3]benzothiazolo[3,2-a]quinolin-12-ium perchlorate Traditional Name: 3-nitro-[1,3]benzothiazolo[3,2-a]quinolin-12-ium perchlorate Formula: C15H9ClN2O6S MolecularWeight: 380.75976

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)[N+]3=C(S2)C=CC4=C3C=CC(=C4)[N+](=O)[O-].[O-]Cl(=O)(=O)=O

Isomeric SMILES

C1=CC=C2C(=C1)[N+]3=C(S2)C=CC4=C3C=CC(=C4)[N+](=O)[O-].[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C15H9N2O2S.ClHO4/c18-17(19)11-6-7-12-10(9-11)5-8-15-16(12)13-3-1-2-4-14(13)20-15;2-1(3,4)5/h1-9H;(H,2,3,4,5)/q+1;/p-1