(E)-2-cyano-2-(1,3-diphenyl-1,2,3,4-tetrazol-1-ium-5-yl)-1-ethoxy-ethenolate

Systemtic Name: (E)-2-cyano-2-(1,3-diphenyl-1,2,3,4-tetrazol-1-ium-5-yl)-1-ethoxy-ethenolate Openeye Name: (E)-2-cyano-2-(1,3-diphenyltetrazol-1-ium-5-yl)-1-ethoxy-ethenolate CAS Name: (E)-2-cyano-2-(1,3-diphenyl-5-tetrazol-1-iumyl)-1-ethoxyethenolate IUPAC Name: (E)-2-cyano-2-(1,3-diphenyltetrazol-1-ium-5-yl)-1-ethoxyethenolate Traditional Name: (E)-2-cyano-2-(1,3-diphenyltetrazol-1-ium-5-yl)-1-ethoxy-ethenolate Formula: C18H15N5O2 MolecularWeight: 333.344

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=C(C#N)C1=NN(N=[N+]1C2=CC=CC=C2)C3=CC=CC=C3)[O-]

Isomeric SMILES

CCO/C(=C(\C#N)/C1=NN(N=[N+]1C2=CC=CC=C2)C3=CC=CC=C3)/[O-]

InChI

InChI=1S/C18H15N5O2/c1-2-25-18(24)16(13-19)17-20-23(15-11-7-4-8-12-15)21-22(17)14-9-5-3-6-10-14/h3-12H,2H2,1H3