(7-chloranyl-4-oxidanylidene-1H-quinazolin-2-yl)methyl (E)-3-quinoxalin-2-ylprop-2-enoate

Systemtic Name: (7-chloranyl-4-oxidanylidene-1H-quinazolin-2-yl)methyl (E)-3-quinoxalin-2-ylprop-2-enoate Openeye Name: (7-chloro-4-oxo-1H-quinazolin-2-yl)methyl (E)-3-quinoxalin-2-ylprop-2-enoate CAS Name: (E)-3-(2-quinoxalinyl)-2-propenoic acid (7-chloro-4-oxo-1H-quinazolin-2-yl)methyl ester IUPAC Name: (7-chloro-4-oxo-1H-quinazolin-2-yl)methyl (E)-3-quinoxalin-2-ylprop-2-enoate Traditional Name: (E)-3-quinoxalin-2-ylacrylic acid (7-chloro-4-keto-1H-quinazolin-2-yl)methyl ester Formula: C20H13ClN4O3 MolecularWeight: 392.79522

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=CC(=N2)C=CC(=O)OCC3=NC(=O)C4=C(N3)C=C(C=C4)Cl

Isomeric SMILES

C1=CC=C2C(=C1)N=CC(=N2)/C=C/C(=O)OCC3=NC(=O)C4=C(N3)C=C(C=C4)Cl

InChI

InChI=1S/C20H13ClN4O3/c21-12-5-7-14-17(9-12)24-18(25-20(14)27)11-28-19(26)8-6-13-10-22-15-3-1-2-4-16(15)23-13/h1-10H,11H2,(H,24,25,27)/b8-6+