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

Systemtic Name: 3-[1-[2-(2-aminophenyl)ethyl]piperidin-4-yl]-2-methyl-3H-isoindol-1-one hydrochloride Openeye Name: 3-[1-[2-(2-aminophenyl)ethyl]-4-piperidyl]-2-methyl-isoindolin-1-one hydrochloride CAS Name: 3-[1-[2-(2-aminophenyl)ethyl]-4-piperidinyl]-2-methyl-3H-isoindol-1-one hydrochloride IUPAC Name: 3-[1-[2-(2-aminophenyl)ethyl]piperidin-4-yl]-2-methyl-3H-isoindol-1-one hydrochloride Traditional Name: 3-[1-[2-(2-aminophenyl)ethyl]-4-piperidyl]-2-methyl-isoindolin-1-one hydrochloride Formula: C22H28ClN3O MolecularWeight: 385.93022

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(C2=CC=CC=C2C1=O)C3CCN(CC3)CCC4=CC=CC=C4N.Cl

Isomeric SMILES

CN1C(C2=CC=CC=C2C1=O)C3CCN(CC3)CCC4=CC=CC=C4N.Cl

InChI

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