N-[4-[(E)-3-(dioxidanyl)prop-2-enoyl]-3,5-dinitro-phenyl]-2,2-dimethyl-butanamide

Systemtic Name: N-[4-[(E)-3-(dioxidanyl)prop-2-enoyl]-3,5-dinitro-phenyl]-2,2-dimethyl-butanamide Openeye Name: N-[4-[(E)-3-hydroperoxyprop-2-enoyl]-3,5-dinitro-phenyl]-2,2-dimethyl-butanamide CAS Name: N-[4-[(E)-3-hydroperoxy-1-oxoprop-2-enyl]-3,5-dinitrophenyl]-2,2-dimethylbutanamide IUPAC Name: N-[4-[(E)-3-hydroperoxyprop-2-enoyl]-3,5-dinitrophenyl]-2,2-dimethylbutanamide Traditional Name: N-[4-[(E)-3-hydroperoxyacryloyl]-3,5-dinitro-phenyl]-2,2-dimethyl-butyramide Formula: C15H17N3O8 MolecularWeight: 367.31078

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C(=O)NC1=CC(=C(C(=C1)[N+](=O)[O-])C(=O)C=COO)[N+](=O)[O-]

Isomeric SMILES

CCC(C)(C)C(=O)NC1=CC(=C(C(=C1)[N+](=O)[O-])C(=O)/C=C/OO)[N+](=O)[O-]

InChI

InChI=1S/C15H17N3O8/c1-4-15(2,3)14(20)16-9-7-10(17(21)22)13(11(8-9)18(23)24)12(19)5-6-26-25/h5-8,25H,4H2,1-3H3,(H,16,20)/b6-5+