tert-butyl 4-(2-methoxy-5-nitro-phenyl)sulfonylpiperazine-1-carboxylate

Systemtic Name: tert-butyl 4-(2-methoxy-5-nitro-phenyl)sulfonylpiperazine-1-carboxylate Openeye Name: tert-butyl 4-(2-methoxy-5-nitro-phenyl)sulfonylpiperazine-1-carboxylate CAS Name: 4-(2-methoxy-5-nitrophenyl)sulfonyl-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(2-methoxy-5-nitrophenyl)sulfonylpiperazine-1-carboxylate Traditional Name: 4-(2-methoxy-5-nitro-phenyl)sulfonylpiperazine-1-carboxylic acid tert-butyl ester Formula: C16H23N3O7S MolecularWeight: 401.43472

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)[N+](=O)[O-])OC

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)[N+](=O)[O-])OC

InChI

InChI=1S/C16H23N3O7S/c1-16(2,3)26-15(20)17-7-9-18(10-8-17)27(23,24)14-11-12(19(21)22)5-6-13(14)25-4/h5-6,11H,7-10H2,1-4H3