2-butyl-N-methyl-N-[(2-nitrophenyl)methyl]-1,3-bis(oxidanylidene)isoindole-5-carboxamide

Systemtic Name: 2-butyl-N-methyl-N-[(2-nitrophenyl)methyl]-1,3-bis(oxidanylidene)isoindole-5-carboxamide Openeye Name: 2-butyl-N-methyl-N-[(2-nitrophenyl)methyl]-1,3-dioxo-isoindoline-5-carboxamide CAS Name: 2-butyl-N-methyl-N-[(2-nitrophenyl)methyl]-1,3-dioxo-5-isoindolecarboxamide IUPAC Name: 2-butyl-N-methyl-N-[(2-nitrophenyl)methyl]-1,3-dioxoisoindole-5-carboxamide Traditional Name: 2-butyl-1,3-diketo-N-methyl-N-(2-nitrobenzyl)isoindoline-5-carboxamide Formula: C21H21N3O5 MolecularWeight: 395.40854

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)N(C)CC3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CCCCN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)N(C)CC3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C21H21N3O5/c1-3-4-11-23-20(26)16-10-9-14(12-17(16)21(23)27)19(25)22(2)13-15-7-5-6-8-18(15)24(28)29/h5-10,12H,3-4,11,13H2,1-2H3