2-[(E)-2-anthracen-9-yl-1-cyano-ethenyl]-6,8-dimethyl-quinazolin-4-olate

Systemtic Name: 2-[(E)-2-anthracen-9-yl-1-cyano-ethenyl]-6,8-dimethyl-quinazolin-4-olate Openeye Name: 2-[(E)-2-(9-anthryl)-1-cyano-vinyl]-6,8-dimethyl-quinazolin-4-olate CAS Name: 2-[(E)-2-(9-anthracenyl)-1-cyanoethenyl]-6,8-dimethyl-4-quinazolinolate IUPAC Name: 2-[(E)-2-anthracen-9-yl-1-cyanoethenyl]-6,8-dimethylquinazolin-4-olate Traditional Name: 2-[(E)-2-(9-anthryl)-1-cyano-vinyl]-6,8-dimethyl-quinazolin-4-olate Formula: C27H18N3O- MolecularWeight: 400.45132

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)C(=NC(=N2)C(=CC3=C4C=CC=CC4=CC5=CC=CC=C53)C#N)[O-])C

Isomeric SMILES

CC1=CC(=C2C(=C1)C(=NC(=N2)/C(=C/C3=C4C=CC=CC4=CC5=CC=CC=C53)/C#N)[O-])C

InChI

InChI=1S/C27H19N3O/c1-16-11-17(2)25-24(12-16)27(31)30-26(29-25)20(15-28)14-23-21-9-5-3-7-18(21)13-19-8-4-6-10-22(19)23/h3-14H,1-2H3,(H,29,30,31)/p-1/b20-14+