[4-(2,3-dihydro-1-benzofuran-5-ylmethyl)piperazin-1-yl]-[1-(4-methoxyphenyl)sulfonylpiperidin-3-yl]methanone

Systemtic Name: [4-(2,3-dihydro-1-benzofuran-5-ylmethyl)piperazin-1-yl]-[1-(4-methoxyphenyl)sulfonylpiperidin-3-yl]methanone Openeye Name: [4-(2,3-dihydrobenzofuran-5-ylmethyl)piperazin-1-yl]-[1-(4-methoxyphenyl)sulfonyl-3-piperidyl]methanone CAS Name: [4-(2,3-dihydrobenzofuran-5-ylmethyl)-1-piperazinyl]-[1-(4-methoxyphenyl)sulfonyl-3-piperidinyl]methanone IUPAC Name: [4-(2,3-dihydro-1-benzofuran-5-ylmethyl)piperazin-1-yl]-[1-(4-methoxyphenyl)sulfonylpiperidin-3-yl]methanone Traditional Name: [4-(coumaran-5-ylmethyl)piperazino]-[1-(4-methoxyphenyl)sulfonyl-3-piperidyl]methanone Formula: C26H33N3O5S MolecularWeight: 499.62232

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)N2CCCC(C2)C(=O)N3CCN(CC3)CC4=CC5=C(C=C4)OCC5

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)N2CCCC(C2)C(=O)N3CCN(CC3)CC4=CC5=C(C=C4)OCC5

InChI

InChI=1S/C26H33N3O5S/c1-33-23-5-7-24(8-6-23)35(31,32)29-11-2-3-22(19-29)26(30)28-14-12-27(13-15-28)18-20-4-9-25-21(17-20)10-16-34-25/h4-9,17,22H,2-3,10-16,18-19H2,1H3