dimethyl (2R,3R)-1-(4-oxidanylidene-2-propan-2-yl-quinazolin-3-yl)aziridine-2,3-dicarboxylate

Systemtic Name: dimethyl (2R,3R)-1-(4-oxidanylidene-2-propan-2-yl-quinazolin-3-yl)aziridine-2,3-dicarboxylate Openeye Name: dimethyl (2R,3R)-1-(2-isopropyl-4-oxo-quinazolin-3-yl)aziridine-2,3-dicarboxylate CAS Name: (2R,3R)-1-(4-oxo-2-propan-2-yl-3-quinazolinyl)aziridine-2,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl (2R,3R)-1-(4-oxo-2-propan-2-ylquinazolin-3-yl)aziridine-2,3-dicarboxylate Traditional Name: (2R,3R)-1-(2-isopropyl-4-keto-quinazolin-3-yl)ethylenimine-2,3-dicarboxylic acid dimethyl ester Formula: C17H19N3O5 MolecularWeight: 345.34986

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NC2=CC=CC=C2C(=O)N1N3C(C3C(=O)OC)C(=O)OC

Isomeric SMILES

CC(C)C1=NC2=CC=CC=C2C(=O)N1N3[C@H]([C@@H]3C(=O)OC)C(=O)OC

InChI

InChI=1S/C17H19N3O5/c1-9(2)14-18-11-8-6-5-7-10(11)15(21)20(14)19-12(16(22)24-3)13(19)17(23)25-4/h5-9,12-13H,1-4H3/t12-,13-/m1/s1