2-[(3aS)-7-methoxy-2-oxidanylidene-3,3a-dihydropyrrolo[3,2-b][1,4]benzothiazin-1-yl]ethyl-dimethyl-azanium

Systemtic Name: 2-[(3aS)-7-methoxy-2-oxidanylidene-3,3a-dihydropyrrolo[3,2-b][1,4]benzothiazin-1-yl]ethyl-dimethyl-azanium Openeye Name: 2-[(3aS)-7-methoxy-2-oxo-3,3a-dihydropyrrolo[3,2-b][1,4]benzothiazin-1-yl]ethyl-dimethyl-ammonium CAS Name: 2-[(3aS)-7-methoxy-2-oxo-3,3a-dihydropyrrolo[3,2-b][1,4]benzothiazin-1-yl]ethyl-dimethylammonium IUPAC Name: 2-[(3aS)-7-methoxy-2-oxo-3,3a-dihydropyrrolo[3,2-b][1,4]benzothiazin-1-yl]ethyl-dimethylazanium Traditional Name: 2-[(3aS)-2-keto-7-methoxy-3,3a-dihydropyrrolo[3,2-b][1,4]benzothiazin-1-yl]ethyl-dimethyl-ammonium Formula: C15H20N3O2S+ MolecularWeight: 306.4032

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCN1C(=O)CC2C1=NC3=C(S2)C=CC(=C3)OC

Isomeric SMILES

C[NH+](C)CCN1C(=O)C[C@H]2C1=NC3=C(S2)C=CC(=C3)OC

InChI

InChI=1S/C15H19N3O2S/c1-17(2)6-7-18-14(19)9-13-15(18)16-11-8-10(20-3)4-5-12(11)21-13/h4-5,8,13H,6-7,9H2,1-3H3/p+1/t13-/m0/s1