2-(aziridin-2-yl)isoindole-1,3-dione; 1-methoxy-3-nitro-benzene

Systemtic Name: 2-(aziridin-2-yl)isoindole-1,3-dione; 1-methoxy-3-nitro-benzene Openeye Name: 2-(aziridin-2-yl)isoindoline-1,3-dione; 1-methoxy-3-nitro-benzene CAS Name: 2-(2-aziridinyl)isoindole-1,3-dione; 1-methoxy-3-nitrobenzene IUPAC Name: 2-(aziridin-2-yl)isoindole-1,3-dione; 1-methoxy-3-nitrobenzene Traditional Name: 2-ethylenimin-2-ylisoindoline-1,3-quinone; 1-methoxy-3-nitro-benzene Formula: C17H15N3O5 MolecularWeight: 341.3181

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)[N+](=O)[O-].C1C(N1)N2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

COC1=CC=CC(=C1)[N+](=O)[O-].C1C(N1)N2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C10H8N2O2.C7H7NO3/c13-9-6-3-1-2-4-7(6)10(14)12(9)8-5-11-8;1-11-7-4-2-3-6(5-7)8(9)10/h1-4,8,11H,5H2;2-5H,1H3