1-(1,3-dihydroisoindol-2-yl)-6-[4-(2-methoxyphenyl)piperazin-1-yl]hexan-1-one

Systemtic Name: 1-(1,3-dihydroisoindol-2-yl)-6-[4-(2-methoxyphenyl)piperazin-1-yl]hexan-1-one Openeye Name: 1-isoindolin-2-yl-6-[4-(2-methoxyphenyl)piperazin-1-yl]hexan-1-one CAS Name: 1-(1,3-dihydroisoindol-2-yl)-6-[4-(2-methoxyphenyl)-1-piperazinyl]-1-hexanone IUPAC Name: 1-(1,3-dihydroisoindol-2-yl)-6-[4-(2-methoxyphenyl)piperazin-1-yl]hexan-1-one Traditional Name: 1-isoindolin-2-yl-6-[4-(2-methoxyphenyl)piperazino]hexan-1-one Formula: C25H33N3O2 MolecularWeight: 407.54842

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CCN(CC2)CCCCCC(=O)N3CC4=CC=CC=C4C3

Isomeric SMILES

COC1=CC=CC=C1N2CCN(CC2)CCCCCC(=O)N3CC4=CC=CC=C4C3

InChI

InChI=1S/C25H33N3O2/c1-30-24-12-7-6-11-23(24)27-17-15-26(16-18-27)14-8-2-3-13-25(29)28-19-21-9-4-5-10-22(21)20-28/h4-7,9-12H,2-3,8,13-20H2,1H3