2-[2-(4-bromanylbutoxy)-5-methoxy-phenyl]-4-methyl-1,4-benzothiazin-3-one

Systemtic Name: 2-[2-(4-bromanylbutoxy)-5-methoxy-phenyl]-4-methyl-1,4-benzothiazin-3-one Openeye Name: 2-[2-(4-bromobutoxy)-5-methoxy-phenyl]-4-methyl-1,4-benzothiazin-3-one CAS Name: 2-[2-(4-bromobutoxy)-5-methoxyphenyl]-4-methyl-1,4-benzothiazin-3-one IUPAC Name: 2-[2-(4-bromobutoxy)-5-methoxyphenyl]-4-methyl-1,4-benzothiazin-3-one Traditional Name: 2-[2-(4-bromobutoxy)-5-methoxy-phenyl]-4-methyl-1,4-benzothiazin-3-one Formula: C20H22BrNO3S MolecularWeight: 436.36258

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2SC(C1=O)C3=C(C=CC(=C3)OC)OCCCCBr

Isomeric SMILES

CN1C2=CC=CC=C2SC(C1=O)C3=C(C=CC(=C3)OC)OCCCCBr

InChI

InChI=1S/C20H22BrNO3S/c1-22-16-7-3-4-8-18(16)26-19(20(22)23)15-13-14(24-2)9-10-17(15)25-12-6-5-11-21/h3-4,7-10,13,19H,5-6,11-12H2,1-2H3