2-[2-[(3-nitrophenyl)methylamino]phenyl]isoindole-1,3-dione

Systemtic Name: 2-[2-[(3-nitrophenyl)methylamino]phenyl]isoindole-1,3-dione Openeye Name: 2-[2-[(3-nitrophenyl)methylamino]phenyl]isoindoline-1,3-dione CAS Name: 2-[2-[(3-nitrophenyl)methylamino]phenyl]isoindole-1,3-dione IUPAC Name: 2-[2-[(3-nitrophenyl)methylamino]phenyl]isoindole-1,3-dione Traditional Name: 2-[2-[(3-nitrobenzyl)amino]phenyl]isoindoline-1,3-quinone Formula: C21H15N3O4 MolecularWeight: 373.3615

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C2=O)C3=CC=CC=C3NCC4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C2=O)C3=CC=CC=C3NCC4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H15N3O4/c25-20-16-8-1-2-9-17(16)21(26)23(20)19-11-4-3-10-18(19)22-13-14-6-5-7-15(12-14)24(27)28/h1-12,22H,13H2