2-methyl-3-(1-phenacylpiperidin-4-yl)-3H-isoindol-1-one hydrochloride

Systemtic Name: 2-methyl-3-(1-phenacylpiperidin-4-yl)-3H-isoindol-1-one hydrochloride Openeye Name: 2-methyl-3-(1-phenacyl-4-piperidyl)isoindolin-1-one hydrochloride CAS Name: 2-methyl-3-(1-phenacyl-4-piperidinyl)-3H-isoindol-1-one hydrochloride IUPAC Name: 2-methyl-3-(1-phenacylpiperidin-4-yl)-3H-isoindol-1-one hydrochloride Traditional Name: 2-methyl-3-(1-phenacyl-4-piperidyl)isoindolin-1-one hydrochloride Formula: C22H25ClN2O2 MolecularWeight: 384.8991

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(C2=CC=CC=C2C1=O)C3CCN(CC3)CC(=O)C4=CC=CC=C4.Cl

Isomeric SMILES

CN1C(C2=CC=CC=C2C1=O)C3CCN(CC3)CC(=O)C4=CC=CC=C4.Cl

InChI

InChI=1S/C22H24N2O2.ClH/c1-23-21(18-9-5-6-10-19(18)22(23)26)17-11-13-24(14-12-17)15-20(25)16-7-3-2-4-8-16;/h2-10,17,21H,11-15H2,1H3;1H