2-(3-methoxypropyl)-N-(2-methyl-3-nitro-phenyl)-1,3-bis(oxidanylidene)isoindole-5-carboxamide

Systemtic Name: 2-(3-methoxypropyl)-N-(2-methyl-3-nitro-phenyl)-1,3-bis(oxidanylidene)isoindole-5-carboxamide Openeye Name: 2-(3-methoxypropyl)-N-(2-methyl-3-nitro-phenyl)-1,3-dioxo-isoindoline-5-carboxamide CAS Name: 2-(3-methoxypropyl)-N-(2-methyl-3-nitrophenyl)-1,3-dioxo-5-isoindolecarboxamide IUPAC Name: 2-(3-methoxypropyl)-N-(2-methyl-3-nitrophenyl)-1,3-dioxoisoindole-5-carboxamide Traditional Name: 1,3-diketo-2-(3-methoxypropyl)-N-(2-methyl-3-nitro-phenyl)isoindoline-5-carboxamide Formula: C20H19N3O6 MolecularWeight: 397.38136

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1[N+](=O)[O-])NC(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)CCCOC

Isomeric SMILES

CC1=C(C=CC=C1[N+](=O)[O-])NC(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)CCCOC

InChI

InChI=1S/C20H19N3O6/c1-12-16(5-3-6-17(12)23(27)28)21-18(24)13-7-8-14-15(11-13)20(26)22(19(14)25)9-4-10-29-2/h3,5-8,11H,4,9-10H2,1-2H3,(H,21,24)