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

Systemtic Name: 4-methyl-1-(2-methyl-5-nitro-phenyl)sulfonyl-2-phenyl-piperazine Openeye Name: 4-methyl-1-(2-methyl-5-nitro-phenyl)sulfonyl-2-phenyl-piperazine CAS Name: 4-methyl-1-(2-methyl-5-nitrophenyl)sulfonyl-2-phenylpiperazine IUPAC Name: 4-methyl-1-(2-methyl-5-nitrophenyl)sulfonyl-2-phenylpiperazine Traditional Name: 4-methyl-1-(2-methyl-5-nitro-phenyl)sulfonyl-2-phenyl-piperazine Formula: C18H21N3O4S MolecularWeight: 375.44204

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)N2CCN(CC2C3=CC=CC=C3)C

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)N2CCN(CC2C3=CC=CC=C3)C

InChI

InChI=1S/C18H21N3O4S/c1-14-8-9-16(21(22)23)12-18(14)26(24,25)20-11-10-19(2)13-17(20)15-6-4-3-5-7-15/h3-9,12,17H,10-11,13H2,1-2H3