2-[2-[(3-nitrophenyl)amino]ethyl]isoindole-1,3-dione

Systemtic Name: 2-[2-[(3-nitrophenyl)amino]ethyl]isoindole-1,3-dione Openeye Name: 2-[2-(3-nitroanilino)ethyl]isoindoline-1,3-dione CAS Name: 2-[2-(3-nitroanilino)ethyl]isoindole-1,3-dione IUPAC Name: 2-[2-(3-nitroanilino)ethyl]isoindole-1,3-dione Traditional Name: 2-[2-(3-nitroanilino)ethyl]isoindoline-1,3-quinone Formula: C16H13N3O4 MolecularWeight: 311.29212

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C2=O)CCNC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C2=O)CCNC3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H13N3O4/c20-15-13-6-1-2-7-14(13)16(21)18(15)9-8-17-11-4-3-5-12(10-11)19(22)23/h1-7,10,17H,8-9H2