1-methyl-4-(5-nitro-2-propan-2-yl-phenyl)sulfonyl-piperazine

Systemtic Name: 1-methyl-4-(5-nitro-2-propan-2-yl-phenyl)sulfonyl-piperazine Openeye Name: 1-(2-isopropyl-5-nitro-phenyl)sulfonyl-4-methyl-piperazine CAS Name: 1-methyl-4-(5-nitro-2-propan-2-ylphenyl)sulfonylpiperazine IUPAC Name: 1-methyl-4-(5-nitro-2-propan-2-ylphenyl)sulfonylpiperazine Traditional Name: 1-(2-isopropyl-5-nitro-phenyl)sulfonyl-4-methyl-piperazine Formula: C14H21N3O4S MolecularWeight: 327.39924

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H21N3O4S/c1-11(2)13-5-4-12(17(18)19)10-14(13)22(20,21)16-8-6-15(3)7-9-16/h4-5,10-11H,6-9H2,1-3H3