(2S)-4-(4-nitrophenyl)sulfonyl-1-phenylmethoxycarbonyl-piperazine-2-carboxylate

Systemtic Name: (2S)-4-(4-nitrophenyl)sulfonyl-1-phenylmethoxycarbonyl-piperazine-2-carboxylate Openeye Name: (2S)-1-benzyloxycarbonyl-4-(4-nitrophenyl)sulfonyl-piperazine-2-carboxylate CAS Name: (2S)-4-(4-nitrophenyl)sulfonyl-1-phenylmethoxycarbonyl-2-piperazinecarboxylate IUPAC Name: (2S)-4-(4-nitrophenyl)sulfonyl-1-phenylmethoxycarbonylpiperazine-2-carboxylate Traditional Name: (2S)-1-carbobenzoxy-4-nosyl-piperazine-2-carboxylate Formula: C19H18N3O8S- MolecularWeight: 448.42652

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(CN1S(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-])C(=O)[O-])C(=O)OCC3=CC=CC=C3

Isomeric SMILES

C1CN([C@@H](CN1S(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-])C(=O)[O-])C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C19H19N3O8S/c23-18(24)17-12-20(31(28,29)16-8-6-15(7-9-16)22(26)27)10-11-21(17)19(25)30-13-14-4-2-1-3-5-14/h1-9,17H,10-13H2,(H,23,24)/p-1/t17-/m0/s1