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

Systemtic Name: 2-[(E)-2-(2-chloranylquinolin-3-yl)-1-cyano-ethenyl]-6-methyl-quinazolin-4-olate Openeye Name: 2-[(E)-2-(2-chloro-3-quinolyl)-1-cyano-vinyl]-6-methyl-quinazolin-4-olate CAS Name: 2-[(E)-2-(2-chloro-3-quinolinyl)-1-cyanoethenyl]-6-methyl-4-quinazolinolate IUPAC Name: 2-[(E)-2-(2-chloroquinolin-3-yl)-1-cyanoethenyl]-6-methylquinazolin-4-olate Traditional Name: 2-[(E)-2-(2-chloro-3-quinolyl)-1-cyano-vinyl]-6-methyl-quinazolin-4-olate Formula: C21H12ClN4O- MolecularWeight: 371.79918

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(N=C2[O-])C(=CC3=CC4=CC=CC=C4N=C3Cl)C#N

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(N=C2[O-])/C(=C/C3=CC4=CC=CC=C4N=C3Cl)/C#N

InChI

InChI=1S/C21H13ClN4O/c1-12-6-7-18-16(8-12)21(27)26-20(25-18)15(11-23)10-14-9-13-4-2-3-5-17(13)24-19(14)22/h2-10H,1H3,(H,25,26,27)/p-1/b15-10+