ethyl (2R,3R)-2,3-bis(3,4-dimethoxyphenyl)-4-nitro-butanoate

Systemtic Name: ethyl (2R,3R)-2,3-bis(3,4-dimethoxyphenyl)-4-nitro-butanoate Openeye Name: ethyl (2R,3R)-2,3-bis(3,4-dimethoxyphenyl)-4-nitro-butanoate CAS Name: (2R,3R)-2,3-bis(3,4-dimethoxyphenyl)-4-nitrobutanoic acid ethyl ester IUPAC Name: ethyl (2R,3R)-2,3-bis(3,4-dimethoxyphenyl)-4-nitrobutanoate Traditional Name: (2R,3R)-2,3-bis(3,4-dimethoxyphenyl)-4-nitro-butyric acid ethyl ester Formula: C22H27NO8 MolecularWeight: 433.45168

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C1=CC(=C(C=C1)OC)OC)C(C[N+](=O)[O-])C2=CC(=C(C=C2)OC)OC

Isomeric SMILES

CCOC(=O)[C@@H](C1=CC(=C(C=C1)OC)OC)[C@@H](C[N+](=O)[O-])C2=CC(=C(C=C2)OC)OC

InChI

InChI=1S/C22H27NO8/c1-6-31-22(24)21(15-8-10-18(28-3)20(12-15)30-5)16(13-23(25)26)14-7-9-17(27-2)19(11-14)29-4/h7-12,16,21H,6,13H2,1-5H3/t16-,21-/m0/s1