9-methoxy-3-nitro-[1,3]benzothiazolo[3,2-a]quinolin-12-ium chloride

Systemtic Name: 9-methoxy-3-nitro-[1,3]benzothiazolo[3,2-a]quinolin-12-ium chloride Openeye Name: 9-methoxy-3-nitro-[1,3]benzothiazolo[3,2-a]quinolin-12-ium chloride CAS Name: 9-methoxy-3-nitro-[1,3]benzothiazolo[3,2-a]quinolin-12-ium chloride IUPAC Name: 9-methoxy-3-nitro-[1,3]benzothiazolo[3,2-a]quinolin-12-ium chloride Traditional Name: 9-methoxy-3-nitro-[1,3]benzothiazolo[3,2-a]quinolin-12-ium chloride Formula: C16H11ClN2O3S MolecularWeight: 346.78814

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)[N+]3=C(S2)C=CC4=C3C=CC(=C4)[N+](=O)[O-].[Cl-]

Isomeric SMILES

COC1=CC2=C(C=C1)[N+]3=C(S2)C=CC4=C3C=CC(=C4)[N+](=O)[O-].[Cl-]

InChI

InChI=1S/C16H11N2O3S.ClH/c1-21-12-4-6-14-15(9-12)22-16-7-2-10-8-11(18(19)20)3-5-13(10)17(14)16;/h2-9H,1H3;1H/q+1;/p-1