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

Systemtic Name: 2-[(E)-2-(2-chloranyl-7-methyl-quinolin-3-yl)-1-cyano-ethenyl]quinazolin-4-olate Openeye Name: 2-[(E)-2-(2-chloro-7-methyl-3-quinolyl)-1-cyano-vinyl]quinazolin-4-olate CAS Name: 2-[(E)-2-(2-chloro-7-methyl-3-quinolinyl)-1-cyanoethenyl]-4-quinazolinolate IUPAC Name: 2-[(E)-2-(2-chloro-7-methylquinolin-3-yl)-1-cyanoethenyl]quinazolin-4-olate Traditional Name: 2-[(E)-2-(2-chloro-7-methyl-3-quinolyl)-1-cyano-vinyl]quinazolin-4-olate Formula: C21H12ClN4O- MolecularWeight: 371.79918

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=NC(=C(C=C2C=C1)C=C(C#N)C3=NC4=CC=CC=C4C(=N3)[O-])Cl

Isomeric SMILES

CC1=CC2=NC(=C(C=C2C=C1)/C=C(\C#N)/C3=NC4=CC=CC=C4C(=N3)[O-])Cl

InChI

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