tert-butyl (2S)-1-(4-diazanyl-3-nitro-phenyl)sulfonylpyrrolidine-2-carboxylate

Systemtic Name: tert-butyl (2S)-1-(4-diazanyl-3-nitro-phenyl)sulfonylpyrrolidine-2-carboxylate Openeye Name: tert-butyl (2S)-1-(4-hydrazino-3-nitro-phenyl)sulfonylpyrrolidine-2-carboxylate CAS Name: (2S)-1-(4-hydrazinyl-3-nitrophenyl)sulfonyl-2-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (2S)-1-(4-hydrazinyl-3-nitrophenyl)sulfonylpyrrolidine-2-carboxylate Traditional Name: (2S)-1-(4-hydrazino-3-nitro-phenyl)sulfonylpyrrolidine-2-carboxylic acid tert-butyl ester Formula: C15H22N4O6S MolecularWeight: 386.42338

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1CCCN1S(=O)(=O)C2=CC(=C(C=C2)NN)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)OC(=O)[C@@H]1CCCN1S(=O)(=O)C2=CC(=C(C=C2)NN)[N+](=O)[O-]

InChI

InChI=1S/C15H22N4O6S/c1-15(2,3)25-14(20)12-5-4-8-18(12)26(23,24)10-6-7-11(17-16)13(9-10)19(21)22/h6-7,9,12,17H,4-5,8,16H2,1-3H3/t12-/m0/s1