N-(2-methylpropyl)-3-[5-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]propanamide

Systemtic Name: N-(2-methylpropyl)-3-[5-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]propanamide Openeye Name: N-isobutyl-3-(5-nitro-1,3-dioxo-isoindolin-2-yl)propanamide CAS Name: N-(2-methylpropyl)-3-(5-nitro-1,3-dioxo-2-isoindolyl)propanamide IUPAC Name: N-(2-methylpropyl)-3-(5-nitro-1,3-dioxoisoindol-2-yl)propanamide Traditional Name: 3-(1,3-diketo-5-nitro-isoindolin-2-yl)-N-isobutyl-propionamide Formula: C15H17N3O5 MolecularWeight: 319.31258

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)CCN1C(=O)C2=C(C1=O)C=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC(C)CNC(=O)CCN1C(=O)C2=C(C1=O)C=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C15H17N3O5/c1-9(2)8-16-13(19)5-6-17-14(20)11-4-3-10(18(22)23)7-12(11)15(17)21/h3-4,7,9H,5-6,8H2,1-2H3,(H,16,19)