(4-nitrophenyl)-(4-propylsulfonylpiperazin-1-yl)methanone

Systemtic Name: (4-nitrophenyl)-(4-propylsulfonylpiperazin-1-yl)methanone Openeye Name: (4-nitrophenyl)-(4-propylsulfonylpiperazin-1-yl)methanone CAS Name: (4-nitrophenyl)-(4-propylsulfonyl-1-piperazinyl)methanone IUPAC Name: (4-nitrophenyl)-(4-propylsulfonylpiperazin-1-yl)methanone Traditional Name: (4-nitrophenyl)-(4-propylsulfonylpiperazino)methanone Formula: C14H19N3O5S MolecularWeight: 341.38276

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Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)N1CCN(CC1)C(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CCCS(=O)(=O)N1CCN(CC1)C(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C14H19N3O5S/c1-2-11-23(21,22)16-9-7-15(8-10-16)14(18)12-3-5-13(6-4-12)17(19)20/h3-6H,2,7-11H2,1H3