4-nitro-2-(2-phenoxyethyl)isoindole-1,3-dione

Systemtic Name: 4-nitro-2-(2-phenoxyethyl)isoindole-1,3-dione Openeye Name: 4-nitro-2-(2-phenoxyethyl)isoindoline-1,3-dione CAS Name: 4-nitro-2-(2-phenoxyethyl)isoindole-1,3-dione IUPAC Name: 4-nitro-2-(2-phenoxyethyl)isoindole-1,3-dione Traditional Name: 4-nitro-2-(2-phenoxyethyl)isoindoline-1,3-quinone Formula: C16H12N2O5 MolecularWeight: 312.27688

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OCCN2C(=O)C3=C(C2=O)C(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)OCCN2C(=O)C3=C(C2=O)C(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H12N2O5/c19-15-12-7-4-8-13(18(21)22)14(12)16(20)17(15)9-10-23-11-5-2-1-3-6-11/h1-8H,9-10H2