[(2R)-1-oxidanylidene-1-(prop-2-enylamino)propan-2-yl] 4-(4-oxidanylidene-1H-quinazolin-2-yl)butanoate

Systemtic Name: [(2R)-1-oxidanylidene-1-(prop-2-enylamino)propan-2-yl] 4-(4-oxidanylidene-1H-quinazolin-2-yl)butanoate Openeye Name: [(1R)-2-(allylamino)-1-methyl-2-oxo-ethyl] 4-(4-oxo-1H-quinazolin-2-yl)butanoate CAS Name: 4-(4-oxo-1H-quinazolin-2-yl)butanoic acid [(2R)-1-oxo-1-(prop-2-enylamino)propan-2-yl] ester IUPAC Name: [(2R)-1-oxo-1-(prop-2-enylamino)propan-2-yl] 4-(4-oxo-1H-quinazolin-2-yl)butanoate Traditional Name: 4-(4-keto-1H-quinazolin-2-yl)butyric acid [(1R)-2-(allylamino)-2-keto-1-methyl-ethyl] ester Formula: C18H21N3O4 MolecularWeight: 343.37704

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC=C)OC(=O)CCCC1=NC(=O)C2=CC=CC=C2N1

Isomeric SMILES

C[C@H](C(=O)NCC=C)OC(=O)CCCC1=NC(=O)C2=CC=CC=C2N1

InChI

InChI=1S/C18H21N3O4/c1-3-11-19-17(23)12(2)25-16(22)10-6-9-15-20-14-8-5-4-7-13(14)18(24)21-15/h3-5,7-8,12H,1,6,9-11H2,2H3,(H,19,23)(H,20,21,24)/t12-/m1/s1