5,6-dimethoxy-2-[[1-[3-(3-methoxyphenyl)propyl]piperidin-3-yl]methyl]-3H-isoindol-1-one

Systemtic Name: 5,6-dimethoxy-2-[[1-[3-(3-methoxyphenyl)propyl]piperidin-3-yl]methyl]-3H-isoindol-1-one Openeye Name: 5,6-dimethoxy-2-[[1-[3-(3-methoxyphenyl)propyl]-3-piperidyl]methyl]isoindolin-1-one CAS Name: 5,6-dimethoxy-2-[[1-[3-(3-methoxyphenyl)propyl]-3-piperidinyl]methyl]-3H-isoindol-1-one IUPAC Name: 5,6-dimethoxy-2-[[1-[3-(3-methoxyphenyl)propyl]piperidin-3-yl]methyl]-3H-isoindol-1-one Traditional Name: 5,6-dimethoxy-2-[[1-[3-(3-methoxyphenyl)propyl]-3-piperidyl]methyl]isoindolin-1-one Formula: C26H34N2O4 MolecularWeight: 438.55916

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CCCN2CCCC(C2)CN3CC4=CC(=C(C=C4C3=O)OC)OC

Isomeric SMILES

COC1=CC=CC(=C1)CCCN2CCCC(C2)CN3CC4=CC(=C(C=C4C3=O)OC)OC

InChI

InChI=1S/C26H34N2O4/c1-30-22-10-4-7-19(13-22)8-5-11-27-12-6-9-20(16-27)17-28-18-21-14-24(31-2)25(32-3)15-23(21)26(28)29/h4,7,10,13-15,20H,5-6,8-9,11-12,16-18H2,1-3H3