N-butyl-2-[4-(2-methyl-5-nitro-phenyl)sulfonylpiperazin-1-yl]ethanamide

Systemtic Name: N-butyl-2-[4-(2-methyl-5-nitro-phenyl)sulfonylpiperazin-1-yl]ethanamide Openeye Name: N-butyl-2-[4-(2-methyl-5-nitro-phenyl)sulfonylpiperazin-1-yl]acetamide CAS Name: N-butyl-2-[4-(2-methyl-5-nitrophenyl)sulfonyl-1-piperazinyl]acetamide IUPAC Name: N-butyl-2-[4-(2-methyl-5-nitrophenyl)sulfonylpiperazin-1-yl]acetamide Traditional Name: N-butyl-2-[4-(2-methyl-5-nitro-phenyl)sulfonylpiperazino]acetamide Formula: C17H26N4O5S MolecularWeight: 398.47714

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H26N4O5S/c1-3-4-7-18-17(22)13-19-8-10-20(11-9-19)27(25,26)16-12-15(21(23)24)6-5-14(16)2/h5-6,12H,3-4,7-11,13H2,1-2H3,(H,18,22)