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

Systemtic Name: methyl (2S,3S,4R,5S)-3-(4-methoxyphenyl)-4-nitro-5-phenyl-pyrrolidine-2-carboxylate Openeye Name: methyl (2S,3S,4R,5S)-3-(4-methoxyphenyl)-4-nitro-5-phenyl-pyrrolidine-2-carboxylate CAS Name: (2S,3S,4R,5S)-3-(4-methoxyphenyl)-4-nitro-5-phenyl-2-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl (2S,3S,4R,5S)-3-(4-methoxyphenyl)-4-nitro-5-phenylpyrrolidine-2-carboxylate Traditional Name: (2S,3S,4R,5S)-3-(4-methoxyphenyl)-4-nitro-5-phenyl-pyrrolidine-2-carboxylic acid methyl ester Formula: C19H20N2O5 MolecularWeight: 356.3725

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Descriptors Computed from Structure

Canonical SMILES:

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

InChI

InChI=1S/C19H20N2O5/c1-25-14-10-8-12(9-11-14)15-17(19(22)26-2)20-16(18(15)21(23)24)13-6-4-3-5-7-13/h3-11,15-18,20H,1-2H3/t15-,16-,17-,18+/m0/s1