(7-chloranyl-4-oxidanylidene-1H-quinazolin-2-yl)methyl 3-(phenoxymethyl)-1-benzofuran-2-carboxylate

Systemtic Name: (7-chloranyl-4-oxidanylidene-1H-quinazolin-2-yl)methyl 3-(phenoxymethyl)-1-benzofuran-2-carboxylate Openeye Name: (7-chloro-4-oxo-1H-quinazolin-2-yl)methyl 3-(phenoxymethyl)benzofuran-2-carboxylate CAS Name: 3-(phenoxymethyl)-2-benzofurancarboxylic acid (7-chloro-4-oxo-1H-quinazolin-2-yl)methyl ester IUPAC Name: (7-chloro-4-oxo-1H-quinazolin-2-yl)methyl 3-(phenoxymethyl)-1-benzofuran-2-carboxylate Traditional Name: 3-(phenoxymethyl)coumarilic acid (7-chloro-4-keto-1H-quinazolin-2-yl)methyl ester Formula: C25H17ClN2O5 MolecularWeight: 460.86588

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OCC2=C(OC3=CC=CC=C32)C(=O)OCC4=NC(=O)C5=C(N4)C=C(C=C5)Cl

Isomeric SMILES

C1=CC=C(C=C1)OCC2=C(OC3=CC=CC=C32)C(=O)OCC4=NC(=O)C5=C(N4)C=C(C=C5)Cl

InChI

InChI=1S/C25H17ClN2O5/c26-15-10-11-18-20(12-15)27-22(28-24(18)29)14-32-25(30)23-19(13-31-16-6-2-1-3-7-16)17-8-4-5-9-21(17)33-23/h1-12H,13-14H2,(H,27,28,29)