ethyl (E)-3-nitro-2-oxidanyl-4-(3,4,5-trimethoxyphenyl)but-3-enoate

Systemtic Name: ethyl (E)-3-nitro-2-oxidanyl-4-(3,4,5-trimethoxyphenyl)but-3-enoate Openeye Name: ethyl (E)-2-hydroxy-3-nitro-4-(3,4,5-trimethoxyphenyl)but-3-enoate CAS Name: (E)-2-hydroxy-3-nitro-4-(3,4,5-trimethoxyphenyl)-3-butenoic acid ethyl ester IUPAC Name: ethyl (E)-2-hydroxy-3-nitro-4-(3,4,5-trimethoxyphenyl)but-3-enoate Traditional Name: (E)-2-hydroxy-3-nitro-4-(3,4,5-trimethoxyphenyl)but-3-enoic acid ethyl ester Formula: C15H19NO8 MolecularWeight: 341.31326

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H19NO8/c1-5-24-15(18)13(17)10(16(19)20)6-9-7-11(21-2)14(23-4)12(8-9)22-3/h6-8,13,17H,5H2,1-4H3/b10-6+