tert-butyl 1-(2-ethyl-4-oxidanylidene-quinazolin-3-yl)aziridine-2-carboxylate

Systemtic Name: tert-butyl 1-(2-ethyl-4-oxidanylidene-quinazolin-3-yl)aziridine-2-carboxylate Openeye Name: tert-butyl 1-(2-ethyl-4-oxo-quinazolin-3-yl)aziridine-2-carboxylate CAS Name: 1-(2-ethyl-4-oxo-3-quinazolinyl)-2-aziridinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 1-(2-ethyl-4-oxoquinazolin-3-yl)aziridine-2-carboxylate Traditional Name: 1-(2-ethyl-4-keto-quinazolin-3-yl)ethylenimine-2-carboxylic acid tert-butyl ester Formula: C17H21N3O3 MolecularWeight: 315.36694

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=CC=CC=C2C(=O)N1N3CC3C(=O)OC(C)(C)C

Isomeric SMILES

CCC1=NC2=CC=CC=C2C(=O)N1N3CC3C(=O)OC(C)(C)C

InChI

InChI=1S/C17H21N3O3/c1-5-14-18-12-9-7-6-8-11(12)15(21)20(14)19-10-13(19)16(22)23-17(2,3)4/h6-9,13H,5,10H2,1-4H3