(4-nitrophenyl)methyl 2-[2-[4-(azidomethyl)phenyl]ethyl]-4-methylsulfonyloxy-pyrrolidine-1-carboxylate

Systemtic Name: (4-nitrophenyl)methyl 2-[2-[4-(azidomethyl)phenyl]ethyl]-4-methylsulfonyloxy-pyrrolidine-1-carboxylate Openeye Name: (4-nitrophenyl)methyl 2-[2-[4-(azidomethyl)phenyl]ethyl]-4-methylsulfonyloxy-pyrrolidine-1-carboxylate CAS Name: 2-[2-[4-(azidomethyl)phenyl]ethyl]-4-methylsulfonyloxy-1-pyrrolidinecarboxylic acid (4-nitrophenyl)methyl ester IUPAC Name: (4-nitrophenyl)methyl 2-[2-[4-(azidomethyl)phenyl]ethyl]-4-methylsulfonyloxypyrrolidine-1-carboxylate Traditional Name: 2-[2-[4-(azidomethyl)phenyl]ethyl]-4-methylsulfonyloxy-pyrrolidine-1-carboxylic acid (4-nitrobenzyl) ester Formula: C22H25N5O7S MolecularWeight: 503.5282

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)OC1CC(N(C1)C(=O)OCC2=CC=C(C=C2)[N+](=O)[O-])CCC3=CC=C(C=C3)CN=[N+]=[N-]

Isomeric SMILES

CS(=O)(=O)OC1CC(N(C1)C(=O)OCC2=CC=C(C=C2)[N+](=O)[O-])CCC3=CC=C(C=C3)CN=[N+]=[N-]

InChI

InChI=1S/C22H25N5O7S/c1-35(31,32)34-21-12-20(11-6-16-2-4-17(5-3-16)13-24-25-23)26(14-21)22(28)33-15-18-7-9-19(10-8-18)27(29)30/h2-5,7-10,20-21H,6,11-15H2,1H3