methyl (2S,3S,4R,5S)-5-(2-methoxyphenyl)-3-(4-methoxyphenyl)-4-nitro-pyrrolidine-2-carboxylate

Systemtic Name: methyl (2S,3S,4R,5S)-5-(2-methoxyphenyl)-3-(4-methoxyphenyl)-4-nitro-pyrrolidine-2-carboxylate Openeye Name: methyl (2S,3S,4R,5S)-5-(2-methoxyphenyl)-3-(4-methoxyphenyl)-4-nitro-pyrrolidine-2-carboxylate CAS Name: (2S,3S,4R,5S)-5-(2-methoxyphenyl)-3-(4-methoxyphenyl)-4-nitro-2-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl (2S,3S,4R,5S)-5-(2-methoxyphenyl)-3-(4-methoxyphenyl)-4-nitropyrrolidine-2-carboxylate Traditional Name: (2S,3S,4R,5S)-5-(2-methoxyphenyl)-3-(4-methoxyphenyl)-4-nitro-pyrrolidine-2-carboxylic acid methyl ester Formula: C20H22N2O6 MolecularWeight: 386.39848

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2C(C(NC2C(=O)OC)C3=CC=CC=C3OC)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)[C@@H]2[C@H]([C@@H](N[C@@H]2C(=O)OC)C3=CC=CC=C3OC)[N+](=O)[O-]

InChI

InChI=1S/C20H22N2O6/c1-26-13-10-8-12(9-11-13)16-18(20(23)28-3)21-17(19(16)22(24)25)14-6-4-5-7-15(14)27-2/h4-11,16-19,21H,1-3H3/t16-,17-,18-,19+/m0/s1