2-cyclopentyl-1-[4-(4-methylsulfonyl-2-nitro-phenyl)piperazin-1-yl]ethanone

Systemtic Name: 2-cyclopentyl-1-[4-(4-methylsulfonyl-2-nitro-phenyl)piperazin-1-yl]ethanone Openeye Name: 2-cyclopentyl-1-[4-(4-methylsulfonyl-2-nitro-phenyl)piperazin-1-yl]ethanone CAS Name: 2-cyclopentyl-1-[4-(4-methylsulfonyl-2-nitrophenyl)-1-piperazinyl]ethanone IUPAC Name: 2-cyclopentyl-1-[4-(4-methylsulfonyl-2-nitrophenyl)piperazin-1-yl]ethanone Traditional Name: 2-cyclopentyl-1-[4-(4-mesyl-2-nitro-phenyl)piperazino]ethanone Formula: C18H25N3O5S MolecularWeight: 395.4732

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC(=C(C=C1)N2CCN(CC2)C(=O)CC3CCCC3)[N+](=O)[O-]

Isomeric SMILES

CS(=O)(=O)C1=CC(=C(C=C1)N2CCN(CC2)C(=O)CC3CCCC3)[N+](=O)[O-]

InChI

InChI=1S/C18H25N3O5S/c1-27(25,26)15-6-7-16(17(13-15)21(23)24)19-8-10-20(11-9-19)18(22)12-14-4-2-3-5-14/h6-7,13-14H,2-5,8-12H2,1H3