4-[2-[1-(cyclopentylmethyl)piperidin-4-yl]-1-oxidanylidene-3H-isoindol-5-yl]benzenecarbonitrile

Systemtic Name: 4-[2-[1-(cyclopentylmethyl)piperidin-4-yl]-1-oxidanylidene-3H-isoindol-5-yl]benzenecarbonitrile Openeye Name: 4-[2-[1-(cyclopentylmethyl)-4-piperidyl]-1-oxo-isoindolin-5-yl]benzonitrile CAS Name: 4-[2-[1-(cyclopentylmethyl)-4-piperidinyl]-1-oxo-3H-isoindol-5-yl]benzonitrile IUPAC Name: 4-[2-[1-(cyclopentylmethyl)piperidin-4-yl]-1-oxo-3H-isoindol-5-yl]benzonitrile Traditional Name: 4-[2-[1-(cyclopentylmethyl)-4-piperidyl]-1-keto-isoindolin-5-yl]benzonitrile Formula: C26H29N3O MolecularWeight: 399.52796

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)CN2CCC(CC2)N3CC4=C(C3=O)C=CC(=C4)C5=CC=C(C=C5)C#N

Isomeric SMILES

C1CCC(C1)CN2CCC(CC2)N3CC4=C(C3=O)C=CC(=C4)C5=CC=C(C=C5)C#N

InChI

InChI=1S/C26H29N3O/c27-16-19-5-7-21(8-6-19)22-9-10-25-23(15-22)18-29(26(25)30)24-11-13-28(14-12-24)17-20-3-1-2-4-20/h5-10,15,20,24H,1-4,11-14,17-18H2