1-[(6-fluoranyl-4H-1,3-benzodioxin-8-yl)methyl]-4-(4-methoxyphenyl)sulfonyl-piperazine

Systemtic Name: 1-[(6-fluoranyl-4H-1,3-benzodioxin-8-yl)methyl]-4-(4-methoxyphenyl)sulfonyl-piperazine Openeye Name: 1-[(6-fluoro-4H-1,3-benzodioxin-8-yl)methyl]-4-(4-methoxyphenyl)sulfonyl-piperazine CAS Name: 1-[(6-fluoro-4H-1,3-benzodioxin-8-yl)methyl]-4-(4-methoxyphenyl)sulfonylpiperazine IUPAC Name: 1-[(6-fluoro-4H-1,3-benzodioxin-8-yl)methyl]-4-(4-methoxyphenyl)sulfonylpiperazine Traditional Name: 1-[(6-fluoro-4H-1,3-benzodioxin-8-yl)methyl]-4-(4-methoxyphenyl)sulfonyl-piperazine Formula: C20H23FN2O5S MolecularWeight: 422.470423

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC3=C4C(=CC(=C3)F)COCO4

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC3=C4C(=CC(=C3)F)COCO4

InChI

InChI=1S/C20H23FN2O5S/c1-26-18-2-4-19(5-3-18)29(24,25)23-8-6-22(7-9-23)12-15-10-17(21)11-16-13-27-14-28-20(15)16/h2-5,10-11H,6-9,12-14H2,1H3