1-(1-benzofuran-2-ylmethyl)-4-(3,4-dimethoxyphenyl)sulfonyl-piperazine

Systemtic Name: 1-(1-benzofuran-2-ylmethyl)-4-(3,4-dimethoxyphenyl)sulfonyl-piperazine Openeye Name: 1-(benzofuran-2-ylmethyl)-4-(3,4-dimethoxyphenyl)sulfonyl-piperazine CAS Name: 1-(2-benzofuranylmethyl)-4-(3,4-dimethoxyphenyl)sulfonylpiperazine IUPAC Name: 1-(1-benzofuran-2-ylmethyl)-4-(3,4-dimethoxyphenyl)sulfonylpiperazine Traditional Name: 1-(benzofuran-2-ylmethyl)-4-(3,4-dimethoxyphenyl)sulfonyl-piperazine Formula: C21H24N2O5S MolecularWeight: 416.49066

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)CC3=CC4=CC=CC=C4O3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)CC3=CC4=CC=CC=C4O3)OC

InChI

InChI=1S/C21H24N2O5S/c1-26-20-8-7-18(14-21(20)27-2)29(24,25)23-11-9-22(10-12-23)15-17-13-16-5-3-4-6-19(16)28-17/h3-8,13-14H,9-12,15H2,1-2H3