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

Systemtic Name: 1-[4-(4-methoxyphenoxy)-3-nitro-phenyl]sulfonyl-4-methyl-piperazine Openeye Name: 1-[4-(4-methoxyphenoxy)-3-nitro-phenyl]sulfonyl-4-methyl-piperazine CAS Name: 1-[4-(4-methoxyphenoxy)-3-nitrophenyl]sulfonyl-4-methylpiperazine IUPAC Name: 1-[4-(4-methoxyphenoxy)-3-nitrophenyl]sulfonyl-4-methylpiperazine Traditional Name: 1-[4-(4-methoxyphenoxy)-3-nitro-phenyl]sulfonyl-4-methyl-piperazine Formula: C18H21N3O6S MolecularWeight: 407.44084

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)OC3=CC=C(C=C3)OC)[N+](=O)[O-]

Isomeric SMILES

CN1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)OC3=CC=C(C=C3)OC)[N+](=O)[O-]

InChI

InChI=1S/C18H21N3O6S/c1-19-9-11-20(12-10-19)28(24,25)16-7-8-18(17(13-16)21(22)23)27-15-5-3-14(26-2)4-6-15/h3-8,13H,9-12H2,1-2H3