2-[(E)-1-cyano-2-[(1R)-cyclohex-3-en-1-yl]ethenyl]quinazolin-4-olate

Systemtic Name: 2-[(E)-1-cyano-2-[(1R)-cyclohex-3-en-1-yl]ethenyl]quinazolin-4-olate Openeye Name: 2-[(E)-1-cyano-2-[(1R)-cyclohex-3-en-1-yl]vinyl]quinazolin-4-olate CAS Name: 2-[(E)-1-cyano-2-[(1R)-1-cyclohex-3-enyl]ethenyl]-4-quinazolinolate IUPAC Name: 2-[(E)-1-cyano-2-[(1R)-cyclohex-3-en-1-yl]ethenyl]quinazolin-4-olate Traditional Name: 2-[(E)-1-cyano-2-[(1R)-cyclohex-3-en-1-yl]vinyl]quinazolin-4-olate Formula: C17H14N3O- MolecularWeight: 276.31256

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CC=C1)C=C(C#N)C2=NC3=CC=CC=C3C(=N2)[O-]

Isomeric SMILES

C1C[C@H](CC=C1)/C=C(\C#N)/C2=NC3=CC=CC=C3C(=N2)[O-]

InChI

InChI=1S/C17H15N3O/c18-11-13(10-12-6-2-1-3-7-12)16-19-15-9-5-4-8-14(15)17(21)20-16/h1-2,4-5,8-10,12H,3,6-7H2,(H,19,20,21)/p-1/b13-10+/t12-/m0/s1