2-butyl-5-(4-nitrophenoxy)isoindole-1,3-dione

Systemtic Name: 2-butyl-5-(4-nitrophenoxy)isoindole-1,3-dione Openeye Name: 2-butyl-5-(4-nitrophenoxy)isoindoline-1,3-dione CAS Name: 2-butyl-5-(4-nitrophenoxy)isoindole-1,3-dione IUPAC Name: 2-butyl-5-(4-nitrophenoxy)isoindole-1,3-dione Traditional Name: 2-butyl-5-(4-nitrophenoxy)isoindoline-1,3-quinone Formula: C18H16N2O5 MolecularWeight: 340.33004

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=C(C1=O)C=C(C=C2)OC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCCCN1C(=O)C2=C(C1=O)C=C(C=C2)OC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H16N2O5/c1-2-3-10-19-17(21)15-9-8-14(11-16(15)18(19)22)25-13-6-4-12(5-7-13)20(23)24/h4-9,11H,2-3,10H2,1H3