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

Systemtic Name: 1-methyl-4-[4-(4-methyl-2-nitro-phenoxy)-3-nitro-phenyl]sulfonyl-piperazine Openeye Name: 1-methyl-4-[4-(4-methyl-2-nitro-phenoxy)-3-nitro-phenyl]sulfonyl-piperazine CAS Name: 1-methyl-4-[4-(4-methyl-2-nitrophenoxy)-3-nitrophenyl]sulfonylpiperazine IUPAC Name: 1-methyl-4-[4-(4-methyl-2-nitrophenoxy)-3-nitrophenyl]sulfonylpiperazine Traditional Name: 1-methyl-4-[4-(4-methyl-2-nitro-phenoxy)-3-nitro-phenyl]sulfonyl-piperazine Formula: C18H20N4O7S MolecularWeight: 436.439

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC2=C(C=C(C=C2)S(=O)(=O)N3CCN(CC3)C)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)OC2=C(C=C(C=C2)S(=O)(=O)N3CCN(CC3)C)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C18H20N4O7S/c1-13-3-5-17(15(11-13)21(23)24)29-18-6-4-14(12-16(18)22(25)26)30(27,28)20-9-7-19(2)8-10-20/h3-6,11-12H,7-10H2,1-2H3