1-(2,3-dihydro-1-benzofuran-5-ylsulfonyl)-4-[(2,5-dimethoxyphenyl)methyl]piperazine

Systemtic Name: 1-(2,3-dihydro-1-benzofuran-5-ylsulfonyl)-4-[(2,5-dimethoxyphenyl)methyl]piperazine Openeye Name: 1-(2,3-dihydrobenzofuran-5-ylsulfonyl)-4-[(2,5-dimethoxyphenyl)methyl]piperazine CAS Name: 1-(2,3-dihydrobenzofuran-5-ylsulfonyl)-4-[(2,5-dimethoxyphenyl)methyl]piperazine IUPAC Name: 1-(2,3-dihydro-1-benzofuran-5-ylsulfonyl)-4-[(2,5-dimethoxyphenyl)methyl]piperazine Traditional Name: 1-coumaran-5-ylsulfonyl-4-(2,5-dimethoxybenzyl)piperazine Formula: C21H26N2O5S MolecularWeight: 418.50654

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)CN2CCN(CC2)S(=O)(=O)C3=CC4=C(C=C3)OCC4

Isomeric SMILES

COC1=CC(=C(C=C1)OC)CN2CCN(CC2)S(=O)(=O)C3=CC4=C(C=C3)OCC4

InChI

InChI=1S/C21H26N2O5S/c1-26-18-3-5-20(27-2)17(13-18)15-22-8-10-23(11-9-22)29(24,25)19-4-6-21-16(14-19)7-12-28-21/h3-6,13-14H,7-12,15H2,1-2H3