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

Systemtic Name: N-(cyclohexylcarbamoyl)-2-[4-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]ethanamide Openeye Name: N-(cyclohexylcarbamoyl)-2-(4-nitro-1,3-dioxo-isoindolin-2-yl)acetamide CAS Name: N-[(cyclohexylamino)-oxomethyl]-2-(4-nitro-1,3-dioxo-2-isoindolyl)acetamide IUPAC Name: N-(cyclohexylcarbamoyl)-2-(4-nitro-1,3-dioxoisoindol-2-yl)acetamide Traditional Name: N-(cyclohexylcarbamoyl)-2-(1,3-diketo-4-nitro-isoindolin-2-yl)acetamide Formula: C17H18N4O6 MolecularWeight: 374.34802

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)NC(=O)CN2C(=O)C3=C(C2=O)C(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1CCC(CC1)NC(=O)NC(=O)CN2C(=O)C3=C(C2=O)C(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H18N4O6/c22-13(19-17(25)18-10-5-2-1-3-6-10)9-20-15(23)11-7-4-8-12(21(26)27)14(11)16(20)24/h4,7-8,10H,1-3,5-6,9H2,(H2,18,19,22,25)