ethyl (2S,4S,5S)-5-(4-methoxyphenyl)-4-nitro-pyrrolidine-2-carboxylate

Systemtic Name: ethyl (2S,4S,5S)-5-(4-methoxyphenyl)-4-nitro-pyrrolidine-2-carboxylate Openeye Name: ethyl (2S,4S,5S)-5-(4-methoxyphenyl)-4-nitro-pyrrolidine-2-carboxylate CAS Name: (2S,4S,5S)-5-(4-methoxyphenyl)-4-nitro-2-pyrrolidinecarboxylic acid ethyl ester IUPAC Name: ethyl (2S,4S,5S)-5-(4-methoxyphenyl)-4-nitropyrrolidine-2-carboxylate Traditional Name: (2S,4S,5S)-5-(4-methoxyphenyl)-4-nitro-pyrrolidine-2-carboxylic acid ethyl ester Formula: C14H18N2O5 MolecularWeight: 294.30312

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CC(C(N1)C2=CC=C(C=C2)OC)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)[C@@H]1C[C@@H]([C@@H](N1)C2=CC=C(C=C2)OC)[N+](=O)[O-]

InChI

InChI=1S/C14H18N2O5/c1-3-21-14(17)11-8-12(16(18)19)13(15-11)9-4-6-10(20-2)7-5-9/h4-7,11-13,15H,3,8H2,1-2H3/t11-,12-,13-/m0/s1