N-[2-(6-methoxy-3-oxidanylidene-2H-1,3-benzothiazol-3-ium-2-yl)ethyl]benzamide

Systemtic Name: N-[2-(6-methoxy-3-oxidanylidene-2H-1,3-benzothiazol-3-ium-2-yl)ethyl]benzamide Openeye Name: N-[2-(6-methoxy-3-oxo-2H-1,3-benzothiazol-3-ium-2-yl)ethyl]benzamide CAS Name: N-[2-(6-methoxy-3-oxo-2H-1,3-benzothiazol-3-ium-2-yl)ethyl]benzamide IUPAC Name: N-[2-(6-methoxy-3-oxo-2H-1,3-benzothiazol-3-ium-2-yl)ethyl]benzamide Traditional Name: N-[2-(3-keto-6-methoxy-2H-1,3-benzothiazol-3-ium-2-yl)ethyl]benzamide Formula: C17H17N2O3S+ MolecularWeight: 329.39348

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)[N+](=O)C(S2)CCNC(=O)C3=CC=CC=C3

Isomeric SMILES

COC1=CC2=C(C=C1)[N+](=O)C(S2)CCNC(=O)C3=CC=CC=C3

InChI

InChI=1S/C17H16N2O3S/c1-22-13-7-8-14-15(11-13)23-16(19(14)21)9-10-18-17(20)12-5-3-2-4-6-12/h2-8,11,16H,9-10H2,1H3/p+1