2-[3-[2-[(1R)-1-bromanylethyl]-4-oxidanylidene-quinazolin-3-yl]propyl]isoindole-1,3-dione

Systemtic Name: 2-[3-[2-[(1R)-1-bromanylethyl]-4-oxidanylidene-quinazolin-3-yl]propyl]isoindole-1,3-dione Openeye Name: 2-[3-[2-[(1R)-1-bromoethyl]-4-oxo-quinazolin-3-yl]propyl]isoindoline-1,3-dione CAS Name: 2-[3-[2-[(1R)-1-bromoethyl]-4-oxo-3-quinazolinyl]propyl]isoindole-1,3-dione IUPAC Name: 2-[3-[2-[(1R)-1-bromoethyl]-4-oxoquinazolin-3-yl]propyl]isoindole-1,3-dione Traditional Name: 2-[3-[2-[(1R)-1-bromoethyl]-4-keto-quinazolin-3-yl]propyl]isoindoline-1,3-quinone Formula: C21H18BrN3O3 MolecularWeight: 440.28992

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC2=CC=CC=C2C(=O)N1CCCN3C(=O)C4=CC=CC=C4C3=O)Br

Isomeric SMILES

C[C@H](C1=NC2=CC=CC=C2C(=O)N1CCCN3C(=O)C4=CC=CC=C4C3=O)Br

InChI

InChI=1S/C21H18BrN3O3/c1-13(22)18-23-17-10-5-4-9-16(17)21(28)24(18)11-6-12-25-19(26)14-7-2-3-8-15(14)20(25)27/h2-5,7-10,13H,6,11-12H2,1H3/t13-/m1/s1