3-[[4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)piperidin-1-yl]methyl]benzenecarbonitrile

Systemtic Name: 3-[[4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)piperidin-1-yl]methyl]benzenecarbonitrile Openeye Name: 3-[[4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-1-piperidyl]methyl]benzonitrile CAS Name: 3-[[4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-1-piperidinyl]methyl]benzonitrile IUPAC Name: 3-[[4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)piperidin-1-yl]methyl]benzonitrile Traditional Name: 3-[[4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)piperidino]methyl]benzonitrile Formula: C23H27N3 MolecularWeight: 345.48058

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CN2CCC3=CC=CC=C3C2)CC4=CC=CC(=C4)C#N

Isomeric SMILES

C1CN(CCC1CN2CCC3=CC=CC=C3C2)CC4=CC=CC(=C4)C#N

InChI

InChI=1S/C23H27N3/c24-15-20-4-3-5-21(14-20)17-25-11-8-19(9-12-25)16-26-13-10-22-6-1-2-7-23(22)18-26/h1-7,14,19H,8-13,16-18H2