cyclobutyl-[4-(2-methyl-5-nitro-phenyl)sulfonylpiperazin-1-yl]methanone

Systemtic Name: cyclobutyl-[4-(2-methyl-5-nitro-phenyl)sulfonylpiperazin-1-yl]methanone Openeye Name: cyclobutyl-[4-(2-methyl-5-nitro-phenyl)sulfonylpiperazin-1-yl]methanone CAS Name: cyclobutyl-[4-(2-methyl-5-nitrophenyl)sulfonyl-1-piperazinyl]methanone IUPAC Name: cyclobutyl-[4-(2-methyl-5-nitrophenyl)sulfonylpiperazin-1-yl]methanone Traditional Name: cyclobutyl-[4-(2-methyl-5-nitro-phenyl)sulfonylpiperazino]methanone Formula: C16H21N3O5S MolecularWeight: 367.42004

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)N2CCN(CC2)C(=O)C3CCC3

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)N2CCN(CC2)C(=O)C3CCC3

InChI

InChI=1S/C16H21N3O5S/c1-12-5-6-14(19(21)22)11-15(12)25(23,24)18-9-7-17(8-10-18)16(20)13-3-2-4-13/h5-6,11,13H,2-4,7-10H2,1H3