methyl 2-[3-[2-(4-oxidanylidenequinazolin-3-yl)ethanoylamino]propanoylamino]benzoate

Systemtic Name: methyl 2-[3-[2-(4-oxidanylidenequinazolin-3-yl)ethanoylamino]propanoylamino]benzoate Openeye Name: methyl 2-[3-[[2-(4-oxoquinazolin-3-yl)acetyl]amino]propanoylamino]benzoate CAS Name: 2-[[1-oxo-3-[[1-oxo-2-(4-oxo-3-quinazolinyl)ethyl]amino]propyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[3-[[2-(4-oxoquinazolin-3-yl)acetyl]amino]propanoylamino]benzoate Traditional Name: 2-[3-[[2-(4-ketoquinazolin-3-yl)acetyl]amino]propanoylamino]benzoic acid methyl ester Formula: C21H20N4O5 MolecularWeight: 408.4073

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1NC(=O)CCNC(=O)CN2C=NC3=CC=CC=C3C2=O

Isomeric SMILES

COC(=O)C1=CC=CC=C1NC(=O)CCNC(=O)CN2C=NC3=CC=CC=C3C2=O

InChI

InChI=1S/C21H20N4O5/c1-30-21(29)15-7-3-5-9-17(15)24-18(26)10-11-22-19(27)12-25-13-23-16-8-4-2-6-14(16)20(25)28/h2-9,13H,10-12H2,1H3,(H,22,27)(H,24,26)