7-chloranyl-4-methyl-2-[2-(oxiran-2-ylmethoxy)phenyl]-2-propan-2-yl-4H-1,2-benzothiazin-2-ium-3-one

Systemtic Name: 7-chloranyl-4-methyl-2-[2-(oxiran-2-ylmethoxy)phenyl]-2-propan-2-yl-4H-1,2-benzothiazin-2-ium-3-one Openeye Name: 7-chloro-2-isopropyl-4-methyl-2-[2-(oxiran-2-ylmethoxy)phenyl]-4H-1,2-benzothiazin-2-ium-3-one CAS Name: 7-chloro-4-methyl-2-[2-(2-oxiranylmethoxy)phenyl]-2-propan-2-yl-4H-1,2-benzothiazin-2-ium-3-one IUPAC Name: 7-chloro-4-methyl-2-[2-(oxiran-2-ylmethoxy)phenyl]-2-propan-2-yl-4H-1,2-benzothiazin-2-ium-3-one Traditional Name: 7-chloro-2-(2-glycidoxyphenyl)-2-isopropyl-4-methyl-4H-1,2-benzothiazin-2-ium-3-one Formula: C21H23ClNO3S+ MolecularWeight: 404.93022

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Descriptors Computed from Structure

Canonical SMILES:

CC1C2=C(C=C(C=C2)Cl)S[N+](C1=O)(C3=CC=CC=C3OCC4CO4)C(C)C

Isomeric SMILES

CC1C2=C(C=C(C=C2)Cl)S[N+](C1=O)(C3=CC=CC=C3OCC4CO4)C(C)C

InChI

InChI=1S/C21H23ClNO3S/c1-13(2)23(18-6-4-5-7-19(18)26-12-16-11-25-16)21(24)14(3)17-9-8-15(22)10-20(17)27-23/h4-10,13-14,16H,11-12H2,1-3H3/q+1