ethyl 4-[4-(4-oxidanylidene-1H-quinazolin-2-yl)butanoylamino]benzoate

Systemtic Name: ethyl 4-[4-(4-oxidanylidene-1H-quinazolin-2-yl)butanoylamino]benzoate Openeye Name: ethyl 4-[4-(4-oxo-1H-quinazolin-2-yl)butanoylamino]benzoate CAS Name: 4-[[1-oxo-4-(4-oxo-1H-quinazolin-2-yl)butyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[4-(4-oxo-1H-quinazolin-2-yl)butanoylamino]benzoate Traditional Name: 4-[4-(4-keto-1H-quinazolin-2-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=C(C=C1)NC(=O)CCCC2=NC(=O)C3=CC=CC=C3N2

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)CCCC2=NC(=O)C3=CC=CC=C3N2

InChI

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