2,3-dihydro-1-benzofuran-5-yl-[4-(2,5-dimethoxyphenyl)sulfonylpiperazin-1-yl]methanone

Systemtic Name: 2,3-dihydro-1-benzofuran-5-yl-[4-(2,5-dimethoxyphenyl)sulfonylpiperazin-1-yl]methanone Openeye Name: 2,3-dihydrobenzofuran-5-yl-[4-(2,5-dimethoxyphenyl)sulfonylpiperazin-1-yl]methanone CAS Name: 2,3-dihydrobenzofuran-5-yl-[4-(2,5-dimethoxyphenyl)sulfonyl-1-piperazinyl]methanone IUPAC Name: 2,3-dihydro-1-benzofuran-5-yl-[4-(2,5-dimethoxyphenyl)sulfonylpiperazin-1-yl]methanone Traditional Name: coumaran-5-yl-[4-(2,5-dimethoxyphenyl)sulfonylpiperazino]methanone Formula: C21H24N2O6S MolecularWeight: 432.49006

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC4=C(C=C3)OCC4

Isomeric SMILES

COC1=CC(=C(C=C1)OC)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC4=C(C=C3)OCC4

InChI

InChI=1S/C21H24N2O6S/c1-27-17-4-6-19(28-2)20(14-17)30(25,26)23-10-8-22(9-11-23)21(24)16-3-5-18-15(13-16)7-12-29-18/h3-6,13-14H,7-12H2,1-2H3