(3-methylsulfonylphenyl)-[4-(4-nitrophenyl)piperazin-1-yl]methanone

Systemtic Name: (3-methylsulfonylphenyl)-[4-(4-nitrophenyl)piperazin-1-yl]methanone Openeye Name: (3-methylsulfonylphenyl)-[4-(4-nitrophenyl)piperazin-1-yl]methanone CAS Name: (3-methylsulfonylphenyl)-[4-(4-nitrophenyl)-1-piperazinyl]methanone IUPAC Name: (3-methylsulfonylphenyl)-[4-(4-nitrophenyl)piperazin-1-yl]methanone Traditional Name: (3-mesylphenyl)-[4-(4-nitrophenyl)piperazino]methanone Formula: C18H19N3O5S MolecularWeight: 389.42556

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC(=C1)C(=O)N2CCN(CC2)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CS(=O)(=O)C1=CC=CC(=C1)C(=O)N2CCN(CC2)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H19N3O5S/c1-27(25,26)17-4-2-3-14(13-17)18(22)20-11-9-19(10-12-20)15-5-7-16(8-6-15)21(23)24/h2-8,13H,9-12H2,1H3