1-[4-(2,3-dihydro-1-benzofuran-5-ylmethyl)piperazin-1-yl]-4-(4-ethanoyl-2-methoxy-phenoxy)butan-1-one

Systemtic Name: 1-[4-(2,3-dihydro-1-benzofuran-5-ylmethyl)piperazin-1-yl]-4-(4-ethanoyl-2-methoxy-phenoxy)butan-1-one Openeye Name: 4-(4-acetyl-2-methoxy-phenoxy)-1-[4-(2,3-dihydrobenzofuran-5-ylmethyl)piperazin-1-yl]butan-1-one CAS Name: 4-(4-acetyl-2-methoxyphenoxy)-1-[4-(2,3-dihydrobenzofuran-5-ylmethyl)-1-piperazinyl]-1-butanone IUPAC Name: 4-(4-acetyl-2-methoxyphenoxy)-1-[4-(2,3-dihydro-1-benzofuran-5-ylmethyl)piperazin-1-yl]butan-1-one Traditional Name: 4-(4-acetyl-2-methoxy-phenoxy)-1-[4-(coumaran-5-ylmethyl)piperazino]butan-1-one Formula: C26H32N2O5 MolecularWeight: 452.54268

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1)OCCCC(=O)N2CCN(CC2)CC3=CC4=C(C=C3)OCC4)OC

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1)OCCCC(=O)N2CCN(CC2)CC3=CC4=C(C=C3)OCC4)OC

InChI

InChI=1S/C26H32N2O5/c1-19(29)21-6-8-24(25(17-21)31-2)32-14-3-4-26(30)28-12-10-27(11-13-28)18-20-5-7-23-22(16-20)9-15-33-23/h5-8,16-17H,3-4,9-15,18H2,1-2H3