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

Systemtic Name: 1-(2,3-dihydro-1-benzofuran-5-ylmethyl)-4-[4-(2-methoxyethoxy)-3-methyl-phenyl]sulfonyl-piperazine Openeye Name: 1-(2,3-dihydrobenzofuran-5-ylmethyl)-4-[4-(2-methoxyethoxy)-3-methyl-phenyl]sulfonyl-piperazine CAS Name: 1-(2,3-dihydrobenzofuran-5-ylmethyl)-4-[4-(2-methoxyethoxy)-3-methylphenyl]sulfonylpiperazine IUPAC Name: 1-(2,3-dihydro-1-benzofuran-5-ylmethyl)-4-[4-(2-methoxyethoxy)-3-methylphenyl]sulfonylpiperazine Traditional Name: 1-(coumaran-5-ylmethyl)-4-[4-(2-methoxyethoxy)-3-methyl-phenyl]sulfonyl-piperazine Formula: C23H30N2O5S MolecularWeight: 446.5597

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H30N2O5S/c1-18-15-21(4-6-22(18)30-14-13-28-2)31(26,27)25-10-8-24(9-11-25)17-19-3-5-23-20(16-19)7-12-29-23/h3-6,15-16H,7-14,17H2,1-2H3