1-[3-(4-fluoranylphenoxy)propyl]-4-(4-methoxy-3-nitro-phenyl)sulfonyl-piperazine

Systemtic Name: 1-[3-(4-fluoranylphenoxy)propyl]-4-(4-methoxy-3-nitro-phenyl)sulfonyl-piperazine Openeye Name: 1-[3-(4-fluorophenoxy)propyl]-4-(4-methoxy-3-nitro-phenyl)sulfonyl-piperazine CAS Name: 1-[3-(4-fluorophenoxy)propyl]-4-(4-methoxy-3-nitrophenyl)sulfonylpiperazine IUPAC Name: 1-[3-(4-fluorophenoxy)propyl]-4-(4-methoxy-3-nitrophenyl)sulfonylpiperazine Traditional Name: 1-[3-(4-fluorophenoxy)propyl]-4-(4-methoxy-3-nitro-phenyl)sulfonyl-piperazine Formula: C20H24FN3O6S MolecularWeight: 453.484463

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)CCCOC3=CC=C(C=C3)F)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)CCCOC3=CC=C(C=C3)F)[N+](=O)[O-]

InChI

InChI=1S/C20H24FN3O6S/c1-29-20-8-7-18(15-19(20)24(25)26)31(27,28)23-12-10-22(11-13-23)9-2-14-30-17-5-3-16(21)4-6-17/h3-8,15H,2,9-14H2,1H3