4-methyl-1-(4-methyl-3-nitro-phenyl)sulfonyl-2-phenyl-piperazine

Systemtic Name: 4-methyl-1-(4-methyl-3-nitro-phenyl)sulfonyl-2-phenyl-piperazine Openeye Name: 4-methyl-1-(4-methyl-3-nitro-phenyl)sulfonyl-2-phenyl-piperazine CAS Name: 4-methyl-1-(4-methyl-3-nitrophenyl)sulfonyl-2-phenylpiperazine IUPAC Name: 4-methyl-1-(4-methyl-3-nitrophenyl)sulfonyl-2-phenylpiperazine Traditional Name: 4-methyl-1-(4-methyl-3-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)S(=O)(=O)N2CCN(CC2C3=CC=CC=C3)C)[N+](=O)[O-]

Isomeric SMILES

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

InChI

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