3-[4-[2,6-bis(fluoranyl)-4-methoxy-phenyl]sulfonylpiperazin-1-yl]sulfonylaniline

Systemtic Name: 3-[4-[2,6-bis(fluoranyl)-4-methoxy-phenyl]sulfonylpiperazin-1-yl]sulfonylaniline Openeye Name: 3-[4-(2,6-difluoro-4-methoxy-phenyl)sulfonylpiperazin-1-yl]sulfonylaniline CAS Name: 3-[[4-(2,6-difluoro-4-methoxyphenyl)sulfonyl-1-piperazinyl]sulfonyl]aniline IUPAC Name: 3-[4-(2,6-difluoro-4-methoxyphenyl)sulfonylpiperazin-1-yl]sulfonylaniline Traditional Name: [3-[4-(2,6-difluoro-4-methoxy-phenyl)sulfonylpiperazino]sulfonylphenyl]amine Formula: C17H19F2N3O5S2 MolecularWeight: 447.476666

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C(=C1)F)S(=O)(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC(=C3)N)F

Isomeric SMILES

COC1=CC(=C(C(=C1)F)S(=O)(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC(=C3)N)F

InChI

InChI=1S/C17H19F2N3O5S2/c1-27-13-10-15(18)17(16(19)11-13)29(25,26)22-7-5-21(6-8-22)28(23,24)14-4-2-3-12(20)9-14/h2-4,9-11H,5-8,20H2,1H3