methyl 4,5-dimethoxy-2-[3-(4-oxidanylidenequinazolin-3-yl)propanoylamino]benzoate

Systemtic Name: methyl 4,5-dimethoxy-2-[3-(4-oxidanylidenequinazolin-3-yl)propanoylamino]benzoate Openeye Name: methyl 4,5-dimethoxy-2-[3-(4-oxoquinazolin-3-yl)propanoylamino]benzoate CAS Name: 4,5-dimethoxy-2-[[1-oxo-3-(4-oxo-3-quinazolinyl)propyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4,5-dimethoxy-2-[3-(4-oxoquinazolin-3-yl)propanoylamino]benzoate Traditional Name: 2-[3-(4-ketoquinazolin-3-yl)propanoylamino]-4,5-dimethoxy-benzoic acid methyl ester Formula: C21H21N3O6 MolecularWeight: 411.40794

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C(=O)OC)NC(=O)CCN2C=NC3=CC=CC=C3C2=O)OC

Isomeric SMILES

COC1=C(C=C(C(=C1)C(=O)OC)NC(=O)CCN2C=NC3=CC=CC=C3C2=O)OC

InChI

InChI=1S/C21H21N3O6/c1-28-17-10-14(21(27)30-3)16(11-18(17)29-2)23-19(25)8-9-24-12-22-15-7-5-4-6-13(15)20(24)26/h4-7,10-12H,8-9H2,1-3H3,(H,23,25)