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

Systemtic Name: methyl (2S,3S,4R,5S)-5-(2-hydroxyphenyl)-3-(4-methoxyphenyl)-4-nitro-pyrrolidine-2-carboxylate Openeye Name: methyl (2S,3S,4R,5S)-5-(2-hydroxyphenyl)-3-(4-methoxyphenyl)-4-nitro-pyrrolidine-2-carboxylate CAS Name: (2S,3S,4R,5S)-5-(2-hydroxyphenyl)-3-(4-methoxyphenyl)-4-nitro-2-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl (2S,3S,4R,5S)-5-(2-hydroxyphenyl)-3-(4-methoxyphenyl)-4-nitropyrrolidine-2-carboxylate Traditional Name: (2S,3S,4R,5S)-5-(2-hydroxyphenyl)-3-(4-methoxyphenyl)-4-nitro-pyrrolidine-2-carboxylic acid methyl ester Formula: C19H20N2O6 MolecularWeight: 372.3719

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2C(C(NC2C(=O)OC)C3=CC=CC=C3O)[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=C3O)[N+](=O)[O-]

InChI

InChI=1S/C19H20N2O6/c1-26-12-9-7-11(8-10-12)15-17(19(23)27-2)20-16(18(15)21(24)25)13-5-3-4-6-14(13)22/h3-10,15-18,20,22H,1-2H3/t15-,16-,17-,18+/m0/s1