1-(2,3-dihydro-1-benzofuran-5-ylmethyl)-4-(4-fluoranyl-2-methyl-phenyl)sulfonyl-piperazine

Systemtic Name: 1-(2,3-dihydro-1-benzofuran-5-ylmethyl)-4-(4-fluoranyl-2-methyl-phenyl)sulfonyl-piperazine Openeye Name: 1-(2,3-dihydrobenzofuran-5-ylmethyl)-4-(4-fluoro-2-methyl-phenyl)sulfonyl-piperazine CAS Name: 1-(2,3-dihydrobenzofuran-5-ylmethyl)-4-(4-fluoro-2-methylphenyl)sulfonylpiperazine IUPAC Name: 1-(2,3-dihydro-1-benzofuran-5-ylmethyl)-4-(4-fluoro-2-methylphenyl)sulfonylpiperazine Traditional Name: 1-(coumaran-5-ylmethyl)-4-(4-fluoro-2-methyl-phenyl)sulfonyl-piperazine Formula: C20H23FN2O3S MolecularWeight: 390.471623

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)F)S(=O)(=O)N2CCN(CC2)CC3=CC4=C(C=C3)OCC4

Isomeric SMILES

CC1=C(C=CC(=C1)F)S(=O)(=O)N2CCN(CC2)CC3=CC4=C(C=C3)OCC4

InChI

InChI=1S/C20H23FN2O3S/c1-15-12-18(21)3-5-20(15)27(24,25)23-9-7-22(8-10-23)14-16-2-4-19-17(13-16)6-11-26-19/h2-5,12-13H,6-11,14H2,1H3