ethyl 3-[4-(4-oxidanylidenequinazolin-3-yl)butanoylamino]benzoate

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

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC=C1)NC(=O)CCCN2C=NC3=CC=CC=C3C2=O

Isomeric SMILES

CCOC(=O)C1=CC(=CC=C1)NC(=O)CCCN2C=NC3=CC=CC=C3C2=O

InChI

InChI=1S/C21H21N3O4/c1-2-28-21(27)15-7-5-8-16(13-15)23-19(25)11-6-12-24-14-22-18-10-4-3-9-17(18)20(24)26/h3-5,7-10,13-14H,2,6,11-12H2,1H3,(H,23,25)