methyl (4E)-3-ethyl-4-(nitromethylidene)-3-oxidanyl-heptanoate

Systemtic Name: methyl (4E)-3-ethyl-4-(nitromethylidene)-3-oxidanyl-heptanoate Openeye Name: methyl (4E)-3-ethyl-3-hydroxy-4-(nitromethylene)heptanoate CAS Name: (4E)-3-ethyl-3-hydroxy-4-(nitromethylidene)heptanoic acid methyl ester IUPAC Name: methyl (4E)-3-ethyl-3-hydroxy-4-(nitromethylidene)heptanoate Traditional Name: (E)-3-ethyl-3-hydroxy-5-nitro-4-propyl-pent-4-enoic acid methyl ester Formula: C11H19NO5 MolecularWeight: 245.27226

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H19NO5/c1-4-6-9(8-12(15)16)11(14,5-2)7-10(13)17-3/h8,14H,4-7H2,1-3H3/b9-8+