methyl 4-[3-(4-oxidanylidenequinazolin-3-yl)propanoylamino]benzoate

Systemtic Name: methyl 4-[3-(4-oxidanylidenequinazolin-3-yl)propanoylamino]benzoate Openeye Name: methyl 4-[3-(4-oxoquinazolin-3-yl)propanoylamino]benzoate CAS Name: 4-[[1-oxo-3-(4-oxo-3-quinazolinyl)propyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[3-(4-oxoquinazolin-3-yl)propanoylamino]benzoate Traditional Name: 4-[3-(4-ketoquinazolin-3-yl)propanoylamino]benzoic acid methyl ester Formula: C19H17N3O4 MolecularWeight: 351.35598

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)NC(=O)CCN2C=NC3=CC=CC=C3C2=O

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)NC(=O)CCN2C=NC3=CC=CC=C3C2=O

InChI

InChI=1S/C19H17N3O4/c1-26-19(25)13-6-8-14(9-7-13)21-17(23)10-11-22-12-20-16-5-3-2-4-15(16)18(22)24/h2-9,12H,10-11H2,1H3,(H,21,23)