5-chloranyl-2-(piperidin-4-ylmethyl)-3H-isoindol-1-one hydrochloride

Systemtic Name: 5-chloranyl-2-(piperidin-4-ylmethyl)-3H-isoindol-1-one hydrochloride Openeye Name: 5-chloro-2-(4-piperidylmethyl)isoindolin-1-one hydrochloride CAS Name: 5-chloro-2-(4-piperidinylmethyl)-3H-isoindol-1-one hydrochloride IUPAC Name: 5-chloro-2-(piperidin-4-ylmethyl)-3H-isoindol-1-one hydrochloride Traditional Name: 5-chloro-2-(4-piperidylmethyl)isoindolin-1-one hydrochloride Formula: C14H18Cl2N2O MolecularWeight: 301.21152

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1CN2CC3=C(C2=O)C=CC(=C3)Cl.Cl

Isomeric SMILES

C1CNCCC1CN2CC3=C(C2=O)C=CC(=C3)Cl.Cl

InChI

InChI=1S/C14H17ClN2O.ClH/c15-12-1-2-13-11(7-12)9-17(14(13)18)8-10-3-5-16-6-4-10;/h1-2,7,10,16H,3-6,8-9H2;1H