cyclohex-3-en-1-yl-[4-(4-methylsulfonyl-2-nitro-phenyl)piperazin-1-yl]methanone

Systemtic Name: cyclohex-3-en-1-yl-[4-(4-methylsulfonyl-2-nitro-phenyl)piperazin-1-yl]methanone Openeye Name: cyclohex-3-en-1-yl-[4-(4-methylsulfonyl-2-nitro-phenyl)piperazin-1-yl]methanone CAS Name: 1-cyclohex-3-enyl-[4-(4-methylsulfonyl-2-nitrophenyl)-1-piperazinyl]methanone IUPAC Name: cyclohex-3-en-1-yl-[4-(4-methylsulfonyl-2-nitrophenyl)piperazin-1-yl]methanone Traditional Name: cyclohex-3-en-1-yl-[4-(4-mesyl-2-nitro-phenyl)piperazino]methanone Formula: C18H23N3O5S MolecularWeight: 393.45732

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC(=C(C=C1)N2CCN(CC2)C(=O)C3CCC=CC3)[N+](=O)[O-]

Isomeric SMILES

CS(=O)(=O)C1=CC(=C(C=C1)N2CCN(CC2)C(=O)C3CCC=CC3)[N+](=O)[O-]

InChI

InChI=1S/C18H23N3O5S/c1-27(25,26)15-7-8-16(17(13-15)21(23)24)19-9-11-20(12-10-19)18(22)14-5-3-2-4-6-14/h2-3,7-8,13-14H,4-6,9-12H2,1H3