2-[[1-[1-(2-aminophenyl)ethyl]piperidin-4-yl]methyl]-3H-isoindol-1-one

Systemtic Name: 2-[[1-[1-(2-aminophenyl)ethyl]piperidin-4-yl]methyl]-3H-isoindol-1-one Openeye Name: 2-[[1-[1-(2-aminophenyl)ethyl]-4-piperidyl]methyl]isoindolin-1-one CAS Name: 2-[[1-[1-(2-aminophenyl)ethyl]-4-piperidinyl]methyl]-3H-isoindol-1-one IUPAC Name: 2-[[1-[1-(2-aminophenyl)ethyl]piperidin-4-yl]methyl]-3H-isoindol-1-one Traditional Name: 2-[[1-[1-(2-aminophenyl)ethyl]-4-piperidyl]methyl]isoindolin-1-one Formula: C22H27N3O MolecularWeight: 349.46928

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1N)N2CCC(CC2)CN3CC4=CC=CC=C4C3=O

Isomeric SMILES

CC(C1=CC=CC=C1N)N2CCC(CC2)CN3CC4=CC=CC=C4C3=O

InChI

InChI=1S/C22H27N3O/c1-16(19-7-4-5-9-21(19)23)24-12-10-17(11-13-24)14-25-15-18-6-2-3-8-20(18)22(25)26/h2-9,16-17H,10-15,23H2,1H3