[2-(3-chloranyl-4-methoxy-phenyl)-2-oxidanylidene-ethyl] 3-(4-oxidanylidene-1H-quinazolin-2-yl)propanoate

Systemtic Name: [2-(3-chloranyl-4-methoxy-phenyl)-2-oxidanylidene-ethyl] 3-(4-oxidanylidene-1H-quinazolin-2-yl)propanoate Openeye Name: [2-(3-chloro-4-methoxy-phenyl)-2-oxo-ethyl] 3-(4-oxo-1H-quinazolin-2-yl)propanoate CAS Name: 3-(4-oxo-1H-quinazolin-2-yl)propanoic acid [2-(3-chloro-4-methoxyphenyl)-2-oxoethyl] ester IUPAC Name: [2-(3-chloro-4-methoxyphenyl)-2-oxoethyl] 3-(4-oxo-1H-quinazolin-2-yl)propanoate Traditional Name: 3-(4-keto-1H-quinazolin-2-yl)propionic acid [2-(3-chloro-4-methoxy-phenyl)-2-keto-ethyl] ester Formula: C20H17ClN2O5 MolecularWeight: 400.81238

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)COC(=O)CCC2=NC(=O)C3=CC=CC=C3N2)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)COC(=O)CCC2=NC(=O)C3=CC=CC=C3N2)Cl

InChI

InChI=1S/C20H17ClN2O5/c1-27-17-7-6-12(10-14(17)21)16(24)11-28-19(25)9-8-18-22-15-5-3-2-4-13(15)20(26)23-18/h2-7,10H,8-9,11H2,1H3,(H,22,23,26)