(Z)-2-diazonio-1-[4-methoxy-2-nitro-3-(phenylmethyl)phenyl]ethenolate

Systemtic Name: (Z)-2-diazonio-1-[4-methoxy-2-nitro-3-(phenylmethyl)phenyl]ethenolate Openeye Name: (Z)-1-(3-benzyl-4-methoxy-2-nitro-phenyl)-2-diazonio-ethenolate CAS Name: (Z)-2-diazonio-1-[4-methoxy-2-nitro-3-(phenylmethyl)phenyl]ethenolate IUPAC Name: (Z)-1-(3-benzyl-4-methoxy-2-nitrophenyl)-2-diazonioethenolate Traditional Name: (Z)-1-(3-benzyl-4-methoxy-2-nitro-phenyl)-2-diazonio-ethenolate Formula: C16H13N3O4 MolecularWeight: 311.29212

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)C(=C[N+]#N)[O-])[N+](=O)[O-])CC2=CC=CC=C2

Isomeric SMILES

COC1=C(C(=C(C=C1)/C(=C/[N+]#N)/[O-])[N+](=O)[O-])CC2=CC=CC=C2

InChI

InChI=1S/C16H13N3O4/c1-23-15-8-7-12(14(20)10-18-17)16(19(21)22)13(15)9-11-5-3-2-4-6-11/h2-8,10H,9H2,1H3/b14-10-