methyl 4-[[3-(4-oxidanylidene-1H-quinazolin-2-yl)propanoylamino]methyl]benzoate

Systemtic Name: methyl 4-[[3-(4-oxidanylidene-1H-quinazolin-2-yl)propanoylamino]methyl]benzoate Openeye Name: methyl 4-[[3-(4-oxo-1H-quinazolin-2-yl)propanoylamino]methyl]benzoate CAS Name: 4-[[[1-oxo-3-(4-oxo-1H-quinazolin-2-yl)propyl]amino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[3-(4-oxo-1H-quinazolin-2-yl)propanoylamino]methyl]benzoate Traditional Name: 4-[[3-(4-keto-1H-quinazolin-2-yl)propanoylamino]methyl]benzoic acid methyl ester Formula: C20H19N3O4 MolecularWeight: 365.38256

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H19N3O4/c1-27-20(26)14-8-6-13(7-9-14)12-21-18(24)11-10-17-22-16-5-3-2-4-15(16)19(25)23-17/h2-9H,10-12H2,1H3,(H,21,24)(H,22,23,25)