2-[4-(4-methylsulfonyl-2-nitro-phenyl)piperazin-1-yl]-N-propyl-ethanamide

Systemtic Name: 2-[4-(4-methylsulfonyl-2-nitro-phenyl)piperazin-1-yl]-N-propyl-ethanamide Openeye Name: 2-[4-(4-methylsulfonyl-2-nitro-phenyl)piperazin-1-yl]-N-propyl-acetamide CAS Name: 2-[4-(4-methylsulfonyl-2-nitrophenyl)-1-piperazinyl]-N-propylacetamide IUPAC Name: 2-[4-(4-methylsulfonyl-2-nitrophenyl)piperazin-1-yl]-N-propylacetamide Traditional Name: 2-[4-(4-mesyl-2-nitro-phenyl)piperazino]-N-propyl-acetamide Formula: C16H24N4O5S MolecularWeight: 384.45056

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H24N4O5S/c1-3-6-17-16(21)12-18-7-9-19(10-8-18)14-5-4-13(26(2,24)25)11-15(14)20(22)23/h4-5,11H,3,6-10,12H2,1-2H3,(H,17,21)