3-(2,6-dimethoxyphenyl)-2-ethoxycarbonyl-4-nitro-butanoate

Systemtic Name: 3-(2,6-dimethoxyphenyl)-2-ethoxycarbonyl-4-nitro-butanoate Openeye Name: 3-(2,6-dimethoxyphenyl)-2-ethoxycarbonyl-4-nitro-butanoate CAS Name: 3-(2,6-dimethoxyphenyl)-2-ethoxycarbonyl-4-nitrobutanoate IUPAC Name: 3-(2,6-dimethoxyphenyl)-2-ethoxycarbonyl-4-nitrobutanoate Traditional Name: 2-carbethoxy-3-(2,6-dimethoxyphenyl)-4-nitro-butyrate Formula: C15H18NO8- MolecularWeight: 340.30532

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(C[N+](=O)[O-])C1=C(C=CC=C1OC)OC)C(=O)[O-]

Isomeric SMILES

CCOC(=O)C(C(C[N+](=O)[O-])C1=C(C=CC=C1OC)OC)C(=O)[O-]

InChI

InChI=1S/C15H19NO8/c1-4-24-15(19)13(14(17)18)9(8-16(20)21)12-10(22-2)6-5-7-11(12)23-3/h5-7,9,13H,4,8H2,1-3H3,(H,17,18)/p-1