(E)-2-(8-methoxy-11-oxidanylidene-6H-benzo[c][1]benzothiepin-3-yl)-2-oxidanyl-ethenediazonium

Systemtic Name: (E)-2-(8-methoxy-11-oxidanylidene-6H-benzo[c][1]benzothiepin-3-yl)-2-oxidanyl-ethenediazonium Openeye Name: (E)-2-hydroxy-2-(8-methoxy-11-oxo-6H-benzo[c][1]benzothiepin-3-yl)ethenediazonium CAS Name: (E)-2-hydroxy-2-(8-methoxy-11-oxo-6H-benzo[c][1]benzothiepin-3-yl)ethenediazonium IUPAC Name: (E)-2-hydroxy-2-(8-methoxy-11-oxo-6H-benzo[c][1]benzothiepin-3-yl)ethenediazonium Traditional Name: (E)-2-hydroxy-2-(11-keto-8-methoxy-6H-benzo[c][1]benzothiepin-3-yl)ethenediazonium Formula: C17H13N2O3S+ MolecularWeight: 325.36172

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=O)C3=C(C=C(C=C3)C(=C[N+]#N)O)SC2

Isomeric SMILES

COC1=CC2=C(C=C1)C(=O)C3=C(C=C(C=C3)/C(=C\[N+]#N)/O)SC2

InChI

InChI=1S/C17H12N2O3S/c1-22-12-3-5-13-11(6-12)9-23-16-7-10(15(20)8-19-18)2-4-14(16)17(13)21/h2-8H,9H2,1H3/p+1/b15-8+