[7-fluoranyl-2-methyl-4-oxidanylidene-6-[(prop-2-ynylamino)methyl]quinazolin-3-yl]methyl 2,2-dimethylpropanoate

Systemtic Name: [7-fluoranyl-2-methyl-4-oxidanylidene-6-[(prop-2-ynylamino)methyl]quinazolin-3-yl]methyl 2,2-dimethylpropanoate Openeye Name: [7-fluoro-2-methyl-4-oxo-6-[(prop-2-ynylamino)methyl]quinazolin-3-yl]methyl 2,2-dimethylpropanoate CAS Name: 2,2-dimethylpropanoic acid [7-fluoro-2-methyl-4-oxo-6-[(prop-2-ynylamino)methyl]-3-quinazolinyl]methyl ester IUPAC Name: [7-fluoro-2-methyl-4-oxo-6-[(prop-2-ynylamino)methyl]quinazolin-3-yl]methyl 2,2-dimethylpropanoate Traditional Name: 2,2-dimethylpropionic acid [7-fluoro-4-keto-2-methyl-6-[(propargylamino)methyl]quinazolin-3-yl]methyl ester Formula: C19H22FN3O3 MolecularWeight: 359.394683

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC(=C(C=C2C(=O)N1COC(=O)C(C)(C)C)CNCC#C)F

Isomeric SMILES

CC1=NC2=CC(=C(C=C2C(=O)N1COC(=O)C(C)(C)C)CNCC#C)F

InChI

InChI=1S/C19H22FN3O3/c1-6-7-21-10-13-8-14-16(9-15(13)20)22-12(2)23(17(14)24)11-26-18(25)19(3,4)5/h1,8-9,21H,7,10-11H2,2-5H3