3-(2-methyl-4-oxidanylidene-quinazolin-3-yl)propyl 4-ethylbenzoate

Systemtic Name: 3-(2-methyl-4-oxidanylidene-quinazolin-3-yl)propyl 4-ethylbenzoate Openeye Name: 3-(2-methyl-4-oxo-quinazolin-3-yl)propyl 4-ethylbenzoate CAS Name: 4-ethylbenzoic acid 3-(2-methyl-4-oxo-3-quinazolinyl)propyl ester IUPAC Name: 3-(2-methyl-4-oxoquinazolin-3-yl)propyl 4-ethylbenzoate Traditional Name: 4-ethylbenzoic acid 3-(4-keto-2-methyl-quinazolin-3-yl)propyl ester Formula: C21H22N2O3 MolecularWeight: 350.41098

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)OCCCN2C(=NC3=CC=CC=C3C2=O)C

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)OCCCN2C(=NC3=CC=CC=C3C2=O)C

InChI

InChI=1S/C21H22N2O3/c1-3-16-9-11-17(12-10-16)21(25)26-14-6-13-23-15(2)22-19-8-5-4-7-18(19)20(23)24/h4-5,7-12H,3,6,13-14H2,1-2H3