2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]-1-[4-(phenylmethyl)sulfonylpiperazin-1-yl]ethanone

Systemtic Name: 2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]-1-[4-(phenylmethyl)sulfonylpiperazin-1-yl]ethanone Openeye Name: 1-(4-benzylsulfonylpiperazin-1-yl)-2-[(2,2-dimethyl-3H-benzofuran-7-yl)oxy]ethanone CAS Name: 2-[(2,2-dimethyl-3H-benzofuran-7-yl)oxy]-1-[4-(phenylmethyl)sulfonyl-1-piperazinyl]ethanone IUPAC Name: 1-(4-benzylsulfonylpiperazin-1-yl)-2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]ethanone Traditional Name: 1-(4-benzylsulfonylpiperazino)-2-(2,2-dimethylcoumaran-7-yl)oxy-ethanone Formula: C23H28N2O5S MolecularWeight: 444.54382

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(O1)C(=CC=C2)OCC(=O)N3CCN(CC3)S(=O)(=O)CC4=CC=CC=C4)C

Isomeric SMILES

CC1(CC2=C(O1)C(=CC=C2)OCC(=O)N3CCN(CC3)S(=O)(=O)CC4=CC=CC=C4)C

InChI

InChI=1S/C23H28N2O5S/c1-23(2)15-19-9-6-10-20(22(19)30-23)29-16-21(26)24-11-13-25(14-12-24)31(27,28)17-18-7-4-3-5-8-18/h3-10H,11-17H2,1-2H3