methyl (2R,3R,4S,5S)-1-ethanoyl-3-(4-methoxyphenyl)-5-(4-methylphenyl)-4-nitro-pyrrolidine-2-carboxylate

Systemtic Name: methyl (2R,3R,4S,5S)-1-ethanoyl-3-(4-methoxyphenyl)-5-(4-methylphenyl)-4-nitro-pyrrolidine-2-carboxylate Openeye Name: methyl (2R,3R,4S,5S)-1-acetyl-3-(4-methoxyphenyl)-4-nitro-5-(p-tolyl)pyrrolidine-2-carboxylate CAS Name: (2R,3R,4S,5S)-1-acetyl-3-(4-methoxyphenyl)-5-(4-methylphenyl)-4-nitro-2-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl (2R,3R,4S,5S)-1-acetyl-3-(4-methoxyphenyl)-5-(4-methylphenyl)-4-nitropyrrolidine-2-carboxylate Traditional Name: (2R,3R,4S,5S)-1-acetyl-3-(4-methoxyphenyl)-4-nitro-5-(p-tolyl)pyrrolidine-2-carboxylic acid methyl ester Formula: C22H24N2O6 MolecularWeight: 412.43576

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2C(C(C(N2C(=O)C)C(=O)OC)C3=CC=C(C=C3)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)[C@H]2[C@H]([C@@H]([C@@H](N2C(=O)C)C(=O)OC)C3=CC=C(C=C3)OC)[N+](=O)[O-]

InChI

InChI=1S/C22H24N2O6/c1-13-5-7-16(8-6-13)19-20(24(27)28)18(15-9-11-17(29-3)12-10-15)21(22(26)30-4)23(19)14(2)25/h5-12,18-21H,1-4H3/t18-,19-,20-,21+/m0/s1