(Z)-3-[2-(azidomethyl)-2,3-dihydroindol-1-yl]-2-diazonio-1-methoxy-3-oxidanylidene-prop-1-en-1-olate

Systemtic Name: (Z)-3-[2-(azidomethyl)-2,3-dihydroindol-1-yl]-2-diazonio-1-methoxy-3-oxidanylidene-prop-1-en-1-olate Openeye Name: (Z)-3-[2-(azidomethyl)indolin-1-yl]-2-diazonio-1-methoxy-3-oxo-prop-1-en-1-olate CAS Name: (Z)-3-[2-(azidomethyl)-2,3-dihydroindol-1-yl]-2-diazonio-1-methoxy-3-oxo-1-propen-1-olate IUPAC Name: (Z)-3-[2-(azidomethyl)-2,3-dihydroindol-1-yl]-2-diazonio-1-methoxy-3-oxoprop-1-en-1-olate Traditional Name: (Z)-3-[2-(azidomethyl)indolin-1-yl]-2-diazonio-3-keto-1-methoxy-prop-1-en-1-olate Formula: C13H12N6O3 MolecularWeight: 300.27278

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Descriptors Computed from Structure

Canonical SMILES:

COC(=C(C(=O)N1C(CC2=CC=CC=C21)CN=[N+]=[N-])[N+]#N)[O-]

Isomeric SMILES

CO/C(=C(/C(=O)N1C(CC2=CC=CC=C21)CN=[N+]=[N-])\[N+]#N)/[O-]

InChI

InChI=1S/C13H12N6O3/c1-22-13(21)11(17-14)12(20)19-9(7-16-18-15)6-8-4-2-3-5-10(8)19/h2-5,9H,6-7H2,1H3