tert-butyl 2-[4-(4-methoxy-3-nitro-phenyl)sulfonylpiperazin-1-yl]ethanoate

Systemtic Name: tert-butyl 2-[4-(4-methoxy-3-nitro-phenyl)sulfonylpiperazin-1-yl]ethanoate Openeye Name: tert-butyl 2-[4-(4-methoxy-3-nitro-phenyl)sulfonylpiperazin-1-yl]acetate CAS Name: 2-[4-(4-methoxy-3-nitrophenyl)sulfonyl-1-piperazinyl]acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-[4-(4-methoxy-3-nitrophenyl)sulfonylpiperazin-1-yl]acetate Traditional Name: 2-[4-(4-methoxy-3-nitro-phenyl)sulfonylpiperazino]acetic acid tert-butyl ester Formula: C17H25N3O7S MolecularWeight: 415.4613

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CN1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)OC)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)OC(=O)CN1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)OC)[N+](=O)[O-]

InChI

InChI=1S/C17H25N3O7S/c1-17(2,3)27-16(21)12-18-7-9-19(10-8-18)28(24,25)13-5-6-15(26-4)14(11-13)20(22)23/h5-6,11H,7-10,12H2,1-4H3