(E)-2-diazonio-1-[(1-phenethylpiperidin-4-yl)-phenyl-amino]ethenolate

Systemtic Name: (E)-2-diazonio-1-[(1-phenethylpiperidin-4-yl)-phenyl-amino]ethenolate Openeye Name: (E)-2-diazonio-1-(N-(1-phenethyl-4-piperidyl)anilino)ethenolate CAS Name: (E)-2-diazonio-1-(N-(1-phenethyl-4-piperidinyl)anilino)ethenolate IUPAC Name: (E)-2-diazonio-1-(N-(1-phenethylpiperidin-4-yl)anilino)ethenolate Traditional Name: (E)-2-diazonio-1-(N-(1-phenethyl-4-piperidyl)anilino)ethenolate Formula: C21H24N4O MolecularWeight: 348.44146

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1N(C2=CC=CC=C2)C(=C[N+]#N)[O-])CCC3=CC=CC=C3

Isomeric SMILES

C1CN(CCC1N(C2=CC=CC=C2)/C(=C\[N+]#N)/[O-])CCC3=CC=CC=C3

InChI

InChI=1S/C21H24N4O/c22-23-17-21(26)25(19-9-5-2-6-10-19)20-12-15-24(16-13-20)14-11-18-7-3-1-4-8-18/h1-10,17,20H,11-16H2/b21-17+