10-chloranyl-2-methyl-3-nitro-[1,3]benzothiazolo[3,2-a]quinolin-12-ium chloride

Systemtic Name: 10-chloranyl-2-methyl-3-nitro-[1,3]benzothiazolo[3,2-a]quinolin-12-ium chloride Openeye Name: 10-chloro-2-methyl-3-nitro-[1,3]benzothiazolo[3,2-a]quinolin-12-ium chloride CAS Name: 10-chloro-2-methyl-3-nitro-[1,3]benzothiazolo[3,2-a]quinolin-12-ium chloride IUPAC Name: 10-chloro-2-methyl-3-nitro-[1,3]benzothiazolo[3,2-a]quinolin-12-ium chloride Traditional Name: 10-chloro-2-methyl-3-nitro-[1,3]benzothiazolo[3,2-a]quinolin-12-ium chloride Formula: C16H10Cl2N2O2S MolecularWeight: 365.2338

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C=CC3=[N+](C2=C1)C4=C(S3)C=CC(=C4)Cl)[N+](=O)[O-].[Cl-]

Isomeric SMILES

CC1=C(C=C2C=CC3=[N+](C2=C1)C4=C(S3)C=CC(=C4)Cl)[N+](=O)[O-].[Cl-]

InChI

InChI=1S/C16H10ClN2O2S.ClH/c1-9-6-13-10(7-12(9)19(20)21)2-5-16-18(13)14-8-11(17)3-4-15(14)22-16;/h2-8H,1H3;1H/q+1;/p-1