ethyl (E)-4-(3-methoxy-4-oxidanyl-phenyl)-3-nitro-2-oxidanyl-but-3-enoate

Systemtic Name: ethyl (E)-4-(3-methoxy-4-oxidanyl-phenyl)-3-nitro-2-oxidanyl-but-3-enoate Openeye Name: ethyl (E)-2-hydroxy-4-(4-hydroxy-3-methoxy-phenyl)-3-nitro-but-3-enoate CAS Name: (E)-2-hydroxy-4-(4-hydroxy-3-methoxyphenyl)-3-nitro-3-butenoic acid ethyl ester IUPAC Name: ethyl (E)-2-hydroxy-4-(4-hydroxy-3-methoxyphenyl)-3-nitrobut-3-enoate Traditional Name: (E)-2-hydroxy-4-(4-hydroxy-3-methoxy-phenyl)-3-nitro-but-3-enoic acid ethyl ester Formula: C13H15NO7 MolecularWeight: 297.2607

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(=CC1=CC(=C(C=C1)O)OC)[N+](=O)[O-])O

Isomeric SMILES

CCOC(=O)C(/C(=C\C1=CC(=C(C=C1)O)OC)/[N+](=O)[O-])O

InChI

InChI=1S/C13H15NO7/c1-3-21-13(17)12(16)9(14(18)19)6-8-4-5-10(15)11(7-8)20-2/h4-7,12,15-16H,3H2,1-2H3/b9-6+