1-[2-[4-(3-piperidin-1-ylpropoxy)phenyl]carbonyl-1,3-dihydroisoindol-5-yl]pyrrolidin-2-one hydrochloride

Systemtic Name: 1-[2-[4-(3-piperidin-1-ylpropoxy)phenyl]carbonyl-1,3-dihydroisoindol-5-yl]pyrrolidin-2-one hydrochloride Openeye Name: 1-[2-[4-[3-(1-piperidyl)propoxy]benzoyl]isoindolin-5-yl]pyrrolidin-2-one hydrochloride CAS Name: 1-[2-[oxo-[4-[3-(1-piperidinyl)propoxy]phenyl]methyl]-1,3-dihydroisoindol-5-yl]-2-pyrrolidinone hydrochloride IUPAC Name: 1-[2-[4-(3-piperidin-1-ylpropoxy)benzoyl]-1,3-dihydroisoindol-5-yl]pyrrolidin-2-one hydrochloride Traditional Name: 1-[2-[4-(3-piperidinopropoxy)benzoyl]isoindolin-5-yl]-2-pyrrolidone hydrochloride Formula: C27H34ClN3O3 MolecularWeight: 484.03016

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCCOC2=CC=C(C=C2)C(=O)N3CC4=C(C3)C=C(C=C4)N5CCCC5=O.Cl

Isomeric SMILES

C1CCN(CC1)CCCOC2=CC=C(C=C2)C(=O)N3CC4=C(C3)C=C(C=C4)N5CCCC5=O.Cl

InChI

InChI=1S/C27H33N3O3.ClH/c31-26-6-4-16-30(26)24-10-7-22-19-29(20-23(22)18-24)27(32)21-8-11-25(12-9-21)33-17-5-15-28-13-2-1-3-14-28;/h7-12,18H,1-6,13-17,19-20H2;1H