4-[[4-(2,3-dihydro-1-benzofuran-5-ylmethyl)piperazin-1-yl]methyl]-7-methoxy-chromen-2-one

Systemtic Name: 4-[[4-(2,3-dihydro-1-benzofuran-5-ylmethyl)piperazin-1-yl]methyl]-7-methoxy-chromen-2-one Openeye Name: 4-[[4-(2,3-dihydrobenzofuran-5-ylmethyl)piperazin-1-yl]methyl]-7-methoxy-chromen-2-one CAS Name: 4-[[4-(2,3-dihydrobenzofuran-5-ylmethyl)-1-piperazinyl]methyl]-7-methoxy-1-benzopyran-2-one IUPAC Name: 4-[[4-(2,3-dihydro-1-benzofuran-5-ylmethyl)piperazin-1-yl]methyl]-7-methoxychromen-2-one Traditional Name: 4-[[4-(coumaran-5-ylmethyl)piperazino]methyl]-7-methoxy-coumarin Formula: C24H26N2O4 MolecularWeight: 406.47424

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=CC(=O)O2)CN3CCN(CC3)CC4=CC5=C(C=C4)OCC5

Isomeric SMILES

COC1=CC2=C(C=C1)C(=CC(=O)O2)CN3CCN(CC3)CC4=CC5=C(C=C4)OCC5

InChI

InChI=1S/C24H26N2O4/c1-28-20-3-4-21-19(13-24(27)30-23(21)14-20)16-26-9-7-25(8-10-26)15-17-2-5-22-18(12-17)6-11-29-22/h2-5,12-14H,6-11,15-16H2,1H3