(E)-4-cycloheptylidene-2-diazonio-3-oxidanylidene-1-phenyl-but-1-en-1-olate

Systemtic Name: (E)-4-cycloheptylidene-2-diazonio-3-oxidanylidene-1-phenyl-but-1-en-1-olate Openeye Name: (E)-4-cycloheptylidene-2-diazonio-3-oxo-1-phenyl-but-1-en-1-olate CAS Name: (E)-4-cycloheptylidene-2-diazonio-3-oxo-1-phenyl-1-buten-1-olate IUPAC Name: (E)-4-cycloheptylidene-2-diazonio-3-oxo-1-phenylbut-1-en-1-olate Traditional Name: (E)-4-cycloheptylidene-2-diazonio-3-keto-1-phenyl-but-1-en-1-olate Formula: C17H18N2O2 MolecularWeight: 282.33702

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(=CC(=O)C(=C(C2=CC=CC=C2)[O-])[N+]#N)CC1

Isomeric SMILES

C1CCCC(=CC(=O)/C(=C(/C2=CC=CC=C2)\[O-])/[N+]#N)CC1

InChI

InChI=1S/C17H18N2O2/c18-19-16(17(21)14-10-6-3-7-11-14)15(20)12-13-8-4-1-2-5-9-13/h3,6-7,10-12H,1-2,4-5,8-9H2