(2S)-4-(4-nitrophenyl)sulfonyl-1-pent-4-enoyl-piperazine-2-carboxylate

Systemtic Name: (2S)-4-(4-nitrophenyl)sulfonyl-1-pent-4-enoyl-piperazine-2-carboxylate Openeye Name: (2S)-4-(4-nitrophenyl)sulfonyl-1-pent-4-enoyl-piperazine-2-carboxylate CAS Name: (2S)-4-(4-nitrophenyl)sulfonyl-1-(1-oxopent-4-enyl)-2-piperazinecarboxylate IUPAC Name: (2S)-4-(4-nitrophenyl)sulfonyl-1-pent-4-enoylpiperazine-2-carboxylate Traditional Name: (2S)-4-nosyl-1-pent-4-enoyl-piperazine-2-carboxylate Formula: C16H18N3O7S- MolecularWeight: 396.39502

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Descriptors Computed from Structure

Canonical SMILES:

C=CCCC(=O)N1CCN(CC1C(=O)[O-])S(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C=CCCC(=O)N1CCN(C[C@H]1C(=O)[O-])S(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C16H19N3O7S/c1-2-3-4-15(20)18-10-9-17(11-14(18)16(21)22)27(25,26)13-7-5-12(6-8-13)19(23)24/h2,5-8,14H,1,3-4,9-11H2,(H,21,22)/p-1/t14-/m0/s1