2-butyl-N-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]-1,3-bis(oxidanylidene)isoindole-5-carboxamide

Systemtic Name: 2-butyl-N-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]-1,3-bis(oxidanylidene)isoindole-5-carboxamide Openeye Name: 2-butyl-N-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]-1,3-dioxo-isoindoline-5-carboxamide CAS Name: 2-butyl-N-[2-(4,5-dimethoxy-2-nitrophenyl)ethyl]-1,3-dioxo-5-isoindolecarboxamide IUPAC Name: 2-butyl-N-[2-(4,5-dimethoxy-2-nitrophenyl)ethyl]-1,3-dioxoisoindole-5-carboxamide Traditional Name: 2-butyl-N-[2-(4,5-dimethoxy-2-nitro-phenyl)ethyl]-1,3-diketo-isoindoline-5-carboxamide Formula: C23H25N3O7 MolecularWeight: 455.4605

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)NCCC3=CC(=C(C=C3[N+](=O)[O-])OC)OC

Isomeric SMILES

CCCCN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)NCCC3=CC(=C(C=C3[N+](=O)[O-])OC)OC

InChI

InChI=1S/C23H25N3O7/c1-4-5-10-25-22(28)16-7-6-15(11-17(16)23(25)29)21(27)24-9-8-14-12-19(32-2)20(33-3)13-18(14)26(30)31/h6-7,11-13H,4-5,8-10H2,1-3H3,(H,24,27)