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

Systemtic Name: methyl 4-[2-[3-(4-oxidanylidenequinazolin-3-yl)propanoylamino]ethyl]benzoate Openeye Name: methyl 4-[2-[3-(4-oxoquinazolin-3-yl)propanoylamino]ethyl]benzoate CAS Name: 4-[2-[[1-oxo-3-(4-oxo-3-quinazolinyl)propyl]amino]ethyl]benzoic acid methyl ester IUPAC Name: methyl 4-[2-[3-(4-oxoquinazolin-3-yl)propanoylamino]ethyl]benzoate Traditional Name: 4-[2-[3-(4-ketoquinazolin-3-yl)propanoylamino]ethyl]benzoic acid methyl ester Formula: C21H21N3O4 MolecularWeight: 379.40914

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H21N3O4/c1-28-21(27)16-8-6-15(7-9-16)10-12-22-19(25)11-13-24-14-23-18-5-3-2-4-17(18)20(24)26/h2-9,14H,10-13H2,1H3,(H,22,25)