N-(4-methylphenyl)-N-[[5-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]methyl]furan-2-carboxamide

Systemtic Name: N-(4-methylphenyl)-N-[[5-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]methyl]furan-2-carboxamide Openeye Name: N-[(5-nitro-1,3-dioxo-isoindolin-2-yl)methyl]-N-(p-tolyl)furan-2-carboxamide CAS Name: N-(4-methylphenyl)-N-[(5-nitro-1,3-dioxo-2-isoindolyl)methyl]-2-furancarboxamide IUPAC Name: N-(4-methylphenyl)-N-[(5-nitro-1,3-dioxoisoindol-2-yl)methyl]furan-2-carboxamide Traditional Name: N-[(1,3-diketo-5-nitro-isoindolin-2-yl)methyl]-N-(p-tolyl)-2-furamide Formula: C21H15N3O6 MolecularWeight: 405.3603

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N(CN2C(=O)C3=C(C2=O)C=C(C=C3)[N+](=O)[O-])C(=O)C4=CC=CO4

Isomeric SMILES

CC1=CC=C(C=C1)N(CN2C(=O)C3=C(C2=O)C=C(C=C3)[N+](=O)[O-])C(=O)C4=CC=CO4

InChI

InChI=1S/C21H15N3O6/c1-13-4-6-14(7-5-13)22(21(27)18-3-2-10-30-18)12-23-19(25)16-9-8-15(24(28)29)11-17(16)20(23)26/h2-11H,12H2,1H3