2-[(2R,3S)-2-methyl-3-propanoyl-aziridin-1-yl]isoindole-1,3-dione

Systemtic Name: 2-[(2R,3S)-2-methyl-3-propanoyl-aziridin-1-yl]isoindole-1,3-dione Openeye Name: 2-[(2R,3S)-2-methyl-3-propanoyl-aziridin-1-yl]isoindoline-1,3-dione CAS Name: 2-[(2R,3S)-2-methyl-3-(1-oxopropyl)-1-aziridinyl]isoindole-1,3-dione IUPAC Name: 2-[(2R,3S)-2-methyl-3-propanoylaziridin-1-yl]isoindole-1,3-dione Traditional Name: 2-[(2R,3S)-2-methyl-3-propionyl-ethylenimin-1-yl]isoindoline-1,3-quinone Formula: C14H14N2O3 MolecularWeight: 258.27256

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1C(N1N2C(=O)C3=CC=CC=C3C2=O)C

Isomeric SMILES

CCC(=O)[C@@H]1[C@H](N1N2C(=O)C3=CC=CC=C3C2=O)C

InChI

InChI=1S/C14H14N2O3/c1-3-11(17)12-8(2)15(12)16-13(18)9-6-4-5-7-10(9)14(16)19/h4-8,12H,3H2,1-2H3/t8-,12+,15?/m1/s1