[(2S)-1-oxidanylidene-1-(prop-2-enylamino)propan-2-yl] 3-(3-methyl-4-oxidanylidene-quinazolin-2-yl)propanoate

Systemtic Name: [(2S)-1-oxidanylidene-1-(prop-2-enylamino)propan-2-yl] 3-(3-methyl-4-oxidanylidene-quinazolin-2-yl)propanoate Openeye Name: [(1S)-2-(allylamino)-1-methyl-2-oxo-ethyl] 3-(3-methyl-4-oxo-quinazolin-2-yl)propanoate CAS Name: 3-(3-methyl-4-oxo-2-quinazolinyl)propanoic acid [(2S)-1-oxo-1-(prop-2-enylamino)propan-2-yl] ester IUPAC Name: [(2S)-1-oxo-1-(prop-2-enylamino)propan-2-yl] 3-(3-methyl-4-oxoquinazolin-2-yl)propanoate Traditional Name: 3-(4-keto-3-methyl-quinazolin-2-yl)propionic acid [(1S)-2-(allylamino)-2-keto-1-methyl-ethyl] ester Formula: C18H21N3O4 MolecularWeight: 343.37704

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC=C)OC(=O)CCC1=NC2=CC=CC=C2C(=O)N1C

Isomeric SMILES

C[C@@H](C(=O)NCC=C)OC(=O)CCC1=NC2=CC=CC=C2C(=O)N1C

InChI

InChI=1S/C18H21N3O4/c1-4-11-19-17(23)12(2)25-16(22)10-9-15-20-14-8-6-5-7-13(14)18(24)21(15)3/h4-8,12H,1,9-11H2,2-3H3,(H,19,23)/t12-/m0/s1