2-[(3aR)-3a-methyl-2-oxidanylidene-3H-pyrrolo[3,2-b][1,4]benzothiazin-1-yl]ethyl-dimethyl-azanium

Systemtic Name: 2-[(3aR)-3a-methyl-2-oxidanylidene-3H-pyrrolo[3,2-b][1,4]benzothiazin-1-yl]ethyl-dimethyl-azanium Openeye Name: 2-[(3aR)-3a-methyl-2-oxo-3H-pyrrolo[3,2-b][1,4]benzothiazin-1-yl]ethyl-dimethyl-ammonium CAS Name: 2-[(3aR)-3a-methyl-2-oxo-3H-pyrrolo[3,2-b][1,4]benzothiazin-1-yl]ethyl-dimethylammonium IUPAC Name: 2-[(3aR)-3a-methyl-2-oxo-3H-pyrrolo[3,2-b][1,4]benzothiazin-1-yl]ethyl-dimethylazanium Traditional Name: 2-[(3aR)-2-keto-3a-methyl-3H-pyrrolo[3,2-b][1,4]benzothiazin-1-yl]ethyl-dimethyl-ammonium Formula: C15H20N3OS+ MolecularWeight: 290.4038

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Descriptors Computed from Structure

Canonical SMILES:

CC12CC(=O)N(C1=NC3=CC=CC=C3S2)CC[NH+](C)C

Isomeric SMILES

C[C@@]12CC(=O)N(C1=NC3=CC=CC=C3S2)CC[NH+](C)C

InChI

InChI=1S/C15H19N3OS/c1-15-10-13(19)18(9-8-17(2)3)14(15)16-11-6-4-5-7-12(11)20-15/h4-7H,8-10H2,1-3H3/p+1/t15-/m1/s1