2-[(E)-2-(2-chloranyl-7,8-dimethyl-quinolin-3-yl)-1-cyano-ethenyl]-6-methyl-quinazolin-4-olate

Systemtic Name: 2-[(E)-2-(2-chloranyl-7,8-dimethyl-quinolin-3-yl)-1-cyano-ethenyl]-6-methyl-quinazolin-4-olate Openeye Name: 2-[(E)-2-(2-chloro-7,8-dimethyl-3-quinolyl)-1-cyano-vinyl]-6-methyl-quinazolin-4-olate CAS Name: 2-[(E)-2-(2-chloro-7,8-dimethyl-3-quinolinyl)-1-cyanoethenyl]-6-methyl-4-quinazolinolate IUPAC Name: 2-[(E)-2-(2-chloro-7,8-dimethylquinolin-3-yl)-1-cyanoethenyl]-6-methylquinazolin-4-olate Traditional Name: 2-[(E)-2-(2-chloro-7,8-dimethyl-3-quinolyl)-1-cyano-vinyl]-6-methyl-quinazolin-4-olate Formula: C23H16ClN4O- MolecularWeight: 399.85234

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(N=C2[O-])C(=CC3=C(N=C4C(=C(C=CC4=C3)C)C)Cl)C#N

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(N=C2[O-])/C(=C/C3=C(N=C4C(=C(C=CC4=C3)C)C)Cl)/C#N

InChI

InChI=1S/C23H17ClN4O/c1-12-4-7-19-18(8-12)23(29)28-22(26-19)17(11-25)10-16-9-15-6-5-13(2)14(3)20(15)27-21(16)24/h4-10H,1-3H3,(H,26,28,29)/p-1/b17-10+