2-[2-oxidanylidene-2-[4-(phenylmethyl)piperazin-1-yl]ethyl]-3H-isoindol-1-one

Systemtic Name: 2-[2-oxidanylidene-2-[4-(phenylmethyl)piperazin-1-yl]ethyl]-3H-isoindol-1-one Openeye Name: 2-[2-(4-benzylpiperazin-1-yl)-2-oxo-ethyl]isoindolin-1-one CAS Name: 2-[2-oxo-2-[4-(phenylmethyl)-1-piperazinyl]ethyl]-3H-isoindol-1-one IUPAC Name: 2-[2-(4-benzylpiperazin-1-yl)-2-oxoethyl]-3H-isoindol-1-one Traditional Name: 2-[2-(4-benzylpiperazino)-2-keto-ethyl]isoindolin-1-one Formula: C21H23N3O2 MolecularWeight: 349.42622

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2)C(=O)CN3CC4=CC=CC=C4C3=O

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)C(=O)CN3CC4=CC=CC=C4C3=O

InChI

InChI=1S/C21H23N3O2/c25-20(16-24-15-18-8-4-5-9-19(18)21(24)26)23-12-10-22(11-13-23)14-17-6-2-1-3-7-17/h1-9H,10-16H2