N-[(3,4-dimethylphenyl)carbamoyl]-2-[5-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]ethanamide

Systemtic Name: N-[(3,4-dimethylphenyl)carbamoyl]-2-[5-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]ethanamide Openeye Name: N-[(3,4-dimethylphenyl)carbamoyl]-2-(5-nitro-1,3-dioxo-isoindolin-2-yl)acetamide CAS Name: N-[(3,4-dimethylanilino)-oxomethyl]-2-(5-nitro-1,3-dioxo-2-isoindolyl)acetamide IUPAC Name: N-[(3,4-dimethylphenyl)carbamoyl]-2-(5-nitro-1,3-dioxoisoindol-2-yl)acetamide Traditional Name: 2-(1,3-diketo-5-nitro-isoindolin-2-yl)-N-[(3,4-dimethylphenyl)carbamoyl]acetamide Formula: C19H16N4O6 MolecularWeight: 396.35354

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)NC(=O)CN2C(=O)C3=C(C2=O)C=C(C=C3)[N+](=O)[O-])C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)NC(=O)CN2C(=O)C3=C(C2=O)C=C(C=C3)[N+](=O)[O-])C

InChI

InChI=1S/C19H16N4O6/c1-10-3-4-12(7-11(10)2)20-19(27)21-16(24)9-22-17(25)14-6-5-13(23(28)29)8-15(14)18(22)26/h3-8H,9H2,1-2H3,(H2,20,21,24,27)