1-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-3-[5-(4-methoxyphenyl)furan-2-yl]propan-1-one

Systemtic Name: 1-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-3-[5-(4-methoxyphenyl)furan-2-yl]propan-1-one Openeye Name: 1-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-3-[5-(4-methoxyphenyl)-2-furyl]propan-1-one CAS Name: 1-[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-3-[5-(4-methoxyphenyl)-2-furanyl]-1-propanone IUPAC Name: 1-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-3-[5-(4-methoxyphenyl)furan-2-yl]propan-1-one Traditional Name: 3-[5-(4-methoxyphenyl)-2-furyl]-1-(4-piperonylpiperazino)propan-1-one Formula: C26H28N2O5 MolecularWeight: 448.51092

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=CC=C(O2)CCC(=O)N3CCN(CC3)CC4=CC5=C(C=C4)OCO5

Isomeric SMILES

COC1=CC=C(C=C1)C2=CC=C(O2)CCC(=O)N3CCN(CC3)CC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C26H28N2O5/c1-30-21-5-3-20(4-6-21)23-10-7-22(33-23)8-11-26(29)28-14-12-27(13-15-28)17-19-2-9-24-25(16-19)32-18-31-24/h2-7,9-10,16H,8,11-15,17-18H2,1H3