methyl (E)-3-ethyl-4-methyl-5-nitro-3-oxidanyl-pent-4-enoate

Systemtic Name: methyl (E)-3-ethyl-4-methyl-5-nitro-3-oxidanyl-pent-4-enoate Openeye Name: methyl (E)-3-ethyl-3-hydroxy-4-methyl-5-nitro-pent-4-enoate CAS Name: (E)-3-ethyl-3-hydroxy-4-methyl-5-nitro-4-pentenoic acid methyl ester IUPAC Name: methyl (E)-3-ethyl-3-hydroxy-4-methyl-5-nitropent-4-enoate Traditional Name: (E)-3-ethyl-3-hydroxy-4-methyl-5-nitro-pent-4-enoic acid methyl ester Formula: C9H15NO5 MolecularWeight: 217.2191

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H15NO5/c1-4-9(12,5-8(11)15-3)7(2)6-10(13)14/h6,12H,4-5H2,1-3H3/b7-6+