1-[4-(2,3-dimethyl-5-nitro-phenyl)sulfonylpiperazin-1-yl]-2-methyl-propan-1-one

Systemtic Name: 1-[4-(2,3-dimethyl-5-nitro-phenyl)sulfonylpiperazin-1-yl]-2-methyl-propan-1-one Openeye Name: 1-[4-(2,3-dimethyl-5-nitro-phenyl)sulfonylpiperazin-1-yl]-2-methyl-propan-1-one CAS Name: 1-[4-(2,3-dimethyl-5-nitrophenyl)sulfonyl-1-piperazinyl]-2-methyl-1-propanone IUPAC Name: 1-[4-(2,3-dimethyl-5-nitrophenyl)sulfonylpiperazin-1-yl]-2-methylpropan-1-one Traditional Name: 1-[4-(2,3-dimethyl-5-nitro-phenyl)sulfonylpiperazino]-2-methyl-propan-1-one Formula: C16H23N3O5S MolecularWeight: 369.43592

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1C)S(=O)(=O)N2CCN(CC2)C(=O)C(C)C)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=CC(=C1C)S(=O)(=O)N2CCN(CC2)C(=O)C(C)C)[N+](=O)[O-]

InChI

InChI=1S/C16H23N3O5S/c1-11(2)16(20)17-5-7-18(8-6-17)25(23,24)15-10-14(19(21)22)9-12(3)13(15)4/h9-11H,5-8H2,1-4H3