2-(5-chloranyl-2-methoxy-phenyl)-2,4-dimethyl-4H-1,2-benzothiazin-2-ium-3-one

Systemtic Name: 2-(5-chloranyl-2-methoxy-phenyl)-2,4-dimethyl-4H-1,2-benzothiazin-2-ium-3-one Openeye Name: 2-(5-chloro-2-methoxy-phenyl)-2,4-dimethyl-4H-1,2-benzothiazin-2-ium-3-one CAS Name: 2-(5-chloro-2-methoxyphenyl)-2,4-dimethyl-4H-1,2-benzothiazin-2-ium-3-one IUPAC Name: 2-(5-chloro-2-methoxyphenyl)-2,4-dimethyl-4H-1,2-benzothiazin-2-ium-3-one Traditional Name: 2-(5-chloro-2-methoxy-phenyl)-2,4-dimethyl-4H-1,2-benzothiazin-2-ium-3-one Formula: C17H17ClNO2S+ MolecularWeight: 334.84038

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Descriptors Computed from Structure

Canonical SMILES:

CC1C2=CC=CC=C2S[N+](C1=O)(C)C3=C(C=CC(=C3)Cl)OC

Isomeric SMILES

CC1C2=CC=CC=C2S[N+](C1=O)(C)C3=C(C=CC(=C3)Cl)OC

InChI

InChI=1S/C17H17ClNO2S/c1-11-13-6-4-5-7-16(13)22-19(2,17(11)20)14-10-12(18)8-9-15(14)21-3/h4-11H,1-3H3/q+1