N-(2-methylpropyl)-4-[5-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]benzamide

Systemtic Name: N-(2-methylpropyl)-4-[5-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]benzamide Openeye Name: N-isobutyl-4-(5-nitro-1,3-dioxo-isoindolin-2-yl)benzamide CAS Name: N-(2-methylpropyl)-4-(5-nitro-1,3-dioxo-2-isoindolyl)benzamide IUPAC Name: N-(2-methylpropyl)-4-(5-nitro-1,3-dioxoisoindol-2-yl)benzamide Traditional Name: 4-(1,3-diketo-5-nitro-isoindolin-2-yl)-N-isobutyl-benzamide Formula: C19H17N3O5 MolecularWeight: 367.35538

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)C1=CC=C(C=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C)CNC(=O)C1=CC=C(C=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H17N3O5/c1-11(2)10-20-17(23)12-3-5-13(6-4-12)21-18(24)15-8-7-14(22(26)27)9-16(15)19(21)25/h3-9,11H,10H2,1-2H3,(H,20,23)