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

Systemtic Name: 2-[(E)-2-(2-chloranyl-8-methyl-quinolin-3-yl)-1-cyano-ethenyl]-6-methyl-quinazolin-4-olate Openeye Name: 2-[(E)-2-(2-chloro-8-methyl-3-quinolyl)-1-cyano-vinyl]-6-methyl-quinazolin-4-olate CAS Name: 2-[(E)-2-(2-chloro-8-methyl-3-quinolinyl)-1-cyanoethenyl]-6-methyl-4-quinazolinolate IUPAC Name: 2-[(E)-2-(2-chloro-8-methylquinolin-3-yl)-1-cyanoethenyl]-6-methylquinazolin-4-olate Traditional Name: 2-[(E)-2-(2-chloro-8-methyl-3-quinolyl)-1-cyano-vinyl]-6-methyl-quinazolin-4-olate Formula: C22H14ClN4O- MolecularWeight: 385.82576

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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(=CC=CC4=C3)C)Cl)C#N

Isomeric SMILES

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

InChI

InChI=1S/C22H15ClN4O/c1-12-6-7-18-17(8-12)22(28)27-21(25-18)16(11-24)10-15-9-14-5-3-4-13(2)19(14)26-20(15)23/h3-10H,1-2H3,(H,25,27,28)/p-1/b16-10+