2-[1-[4-(phenylmethyl)phenyl]piperidin-4-yl]-3H-isoindol-1-one

Systemtic Name: 2-[1-[4-(phenylmethyl)phenyl]piperidin-4-yl]-3H-isoindol-1-one Openeye Name: 2-[1-(4-benzylphenyl)-4-piperidyl]isoindolin-1-one CAS Name: 2-[1-[4-(phenylmethyl)phenyl]-4-piperidinyl]-3H-isoindol-1-one IUPAC Name: 2-[1-(4-benzylphenyl)piperidin-4-yl]-3H-isoindol-1-one Traditional Name: 2-[1-(4-benzylphenyl)-4-piperidyl]isoindolin-1-one Formula: C26H26N2O MolecularWeight: 382.49744

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1N2CC3=CC=CC=C3C2=O)C4=CC=C(C=C4)CC5=CC=CC=C5

Isomeric SMILES

C1CN(CCC1N2CC3=CC=CC=C3C2=O)C4=CC=C(C=C4)CC5=CC=CC=C5

InChI

InChI=1S/C26H26N2O/c29-26-25-9-5-4-8-22(25)19-28(26)24-14-16-27(17-15-24)23-12-10-21(11-13-23)18-20-6-2-1-3-7-20/h1-13,24H,14-19H2