(E)-2-methyl-4-(nitromethyl)hex-2-enoate

Systemtic Name: (E)-2-methyl-4-(nitromethyl)hex-2-enoate Openeye Name: (E)-2-methyl-4-(nitromethyl)hex-2-enoate CAS Name: (E)-2-methyl-4-(nitromethyl)-2-hexenoate IUPAC Name: (E)-2-methyl-4-(nitromethyl)hex-2-enoate Traditional Name: (E)-2-methyl-4-(nitromethyl)hex-2-enoate Formula: C8H12NO4- MolecularWeight: 186.18518

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C[N+](=O)[O-])C=C(C)C(=O)[O-]

Isomeric SMILES

CCC(C[N+](=O)[O-])/C=C(\C)/C(=O)[O-]

InChI

InChI=1S/C8H13NO4/c1-3-7(5-9(12)13)4-6(2)8(10)11/h4,7H,3,5H2,1-2H3,(H,10,11)/p-1/b6-4+