(2S)-1-(2-propan-2-ylquinazolin-4-yl)pyrrolidine-2-carboxylate

Systemtic Name: (2S)-1-(2-propan-2-ylquinazolin-4-yl)pyrrolidine-2-carboxylate Openeye Name: (2S)-1-(2-isopropylquinazolin-4-yl)pyrrolidine-2-carboxylate CAS Name: (2S)-1-(2-propan-2-yl-4-quinazolinyl)-2-pyrrolidinecarboxylate IUPAC Name: (2S)-1-(2-propan-2-ylquinazolin-4-yl)pyrrolidine-2-carboxylate Traditional Name: (2S)-1-(2-isopropylquinazolin-4-yl)pyrrolidine-2-carboxylate Formula: C16H18N3O2- MolecularWeight: 284.33302

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NC2=CC=CC=C2C(=N1)N3CCCC3C(=O)[O-]

Isomeric SMILES

CC(C)C1=NC2=CC=CC=C2C(=N1)N3CCC[C@H]3C(=O)[O-]

InChI

InChI=1S/C16H19N3O2/c1-10(2)14-17-12-7-4-3-6-11(12)15(18-14)19-9-5-8-13(19)16(20)21/h3-4,6-7,10,13H,5,8-9H2,1-2H3,(H,20,21)/p-1/t13-/m0/s1