N-[2-(5-methoxy-3-oxidanylidene-2H-1,3-benzothiazol-3-ium-2-yl)ethyl]cyclopropanecarboxamide

Systemtic Name: N-[2-(5-methoxy-3-oxidanylidene-2H-1,3-benzothiazol-3-ium-2-yl)ethyl]cyclopropanecarboxamide Openeye Name: N-[2-(5-methoxy-3-oxo-2H-1,3-benzothiazol-3-ium-2-yl)ethyl]cyclopropanecarboxamide CAS Name: N-[2-(5-methoxy-3-oxo-2H-1,3-benzothiazol-3-ium-2-yl)ethyl]cyclopropanecarboxamide IUPAC Name: N-[2-(5-methoxy-3-oxo-2H-1,3-benzothiazol-3-ium-2-yl)ethyl]cyclopropanecarboxamide Traditional Name: N-[2-(3-keto-5-methoxy-2H-1,3-benzothiazol-3-ium-2-yl)ethyl]cyclopropanecarboxamide Formula: C14H17N2O3S+ MolecularWeight: 293.36138

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)SC([N+]2=O)CCNC(=O)C3CC3

Isomeric SMILES

COC1=CC2=C(C=C1)SC([N+]2=O)CCNC(=O)C3CC3

InChI

InChI=1S/C14H16N2O3S/c1-19-10-4-5-12-11(8-10)16(18)13(20-12)6-7-15-14(17)9-2-3-9/h4-5,8-9,13H,2-3,6-7H2,1H3/p+1