1-[3-(4-fluoranylphenoxy)propyl]-4-(2-methyl-5-nitro-phenyl)sulfonyl-piperazine

Systemtic Name: 1-[3-(4-fluoranylphenoxy)propyl]-4-(2-methyl-5-nitro-phenyl)sulfonyl-piperazine Openeye Name: 1-[3-(4-fluorophenoxy)propyl]-4-(2-methyl-5-nitro-phenyl)sulfonyl-piperazine CAS Name: 1-[3-(4-fluorophenoxy)propyl]-4-(2-methyl-5-nitrophenyl)sulfonylpiperazine IUPAC Name: 1-[3-(4-fluorophenoxy)propyl]-4-(2-methyl-5-nitrophenyl)sulfonylpiperazine Traditional Name: 1-[3-(4-fluorophenoxy)propyl]-4-(2-methyl-5-nitro-phenyl)sulfonyl-piperazine Formula: C20H24FN3O5S MolecularWeight: 437.485063

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)N2CCN(CC2)CCCOC3=CC=C(C=C3)F

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)N2CCN(CC2)CCCOC3=CC=C(C=C3)F

InChI

InChI=1S/C20H24FN3O5S/c1-16-3-6-18(24(25)26)15-20(16)30(27,28)23-12-10-22(11-13-23)9-2-14-29-19-7-4-17(21)5-8-19/h3-8,15H,2,9-14H2,1H3