2-[[2-[(3,4-dimethoxyphenyl)methylidene]-3-oxidanylidene-4H-1,4-benzothiazin-6-yl]carbonylamino]ethyl-diethyl-azanium

Systemtic Name: 2-[[2-[(3,4-dimethoxyphenyl)methylidene]-3-oxidanylidene-4H-1,4-benzothiazin-6-yl]carbonylamino]ethyl-diethyl-azanium Openeye Name: 2-[[2-[(3,4-dimethoxyphenyl)methylene]-3-oxo-4H-1,4-benzothiazine-6-carbonyl]amino]ethyl-diethyl-ammonium CAS Name: 2-[[[2-[(3,4-dimethoxyphenyl)methylidene]-3-oxo-4H-1,4-benzothiazin-6-yl]-oxomethyl]amino]ethyl-diethylammonium IUPAC Name: 2-[[2-[(3,4-dimethoxyphenyl)methylidene]-3-oxo-4H-1,4-benzothiazine-6-carbonyl]amino]ethyl-diethylazanium Traditional Name: diethyl-[2-[(3-keto-2-veratrylidene-4H-1,4-benzothiazine-6-carbonyl)amino]ethyl]ammonium Formula: C24H30N3O4S+ MolecularWeight: 456.5777

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCNC(=O)C1=CC2=C(C=C1)SC(=CC3=CC(=C(C=C3)OC)OC)C(=O)N2

Isomeric SMILES

CC[NH+](CC)CCNC(=O)C1=CC2=C(C=C1)SC(=CC3=CC(=C(C=C3)OC)OC)C(=O)N2

InChI

InChI=1S/C24H29N3O4S/c1-5-27(6-2)12-11-25-23(28)17-8-10-21-18(15-17)26-24(29)22(32-21)14-16-7-9-19(30-3)20(13-16)31-4/h7-10,13-15H,5-6,11-12H2,1-4H3,(H,25,28)(H,26,29)/p+1