1-[[5-(phenylmethyl)-2,3-dihydro-1-benzofuran-2-yl]methyl]piperidine-4-carbonitrile

Systemtic Name: 1-[[5-(phenylmethyl)-2,3-dihydro-1-benzofuran-2-yl]methyl]piperidine-4-carbonitrile Openeye Name: 1-[(5-benzyl-2,3-dihydrobenzofuran-2-yl)methyl]piperidine-4-carbonitrile CAS Name: 1-[[5-(phenylmethyl)-2,3-dihydrobenzofuran-2-yl]methyl]-4-piperidinecarbonitrile IUPAC Name: 1-[(5-benzyl-2,3-dihydro-1-benzofuran-2-yl)methyl]piperidine-4-carbonitrile Traditional Name: 1-[(5-benzylcoumaran-2-yl)methyl]isonipecotonitrile Formula: C22H24N2O MolecularWeight: 332.43876

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C#N)CC2CC3=C(O2)C=CC(=C3)CC4=CC=CC=C4

Isomeric SMILES

C1CN(CCC1C#N)CC2CC3=C(O2)C=CC(=C3)CC4=CC=CC=C4

InChI

InChI=1S/C22H24N2O/c23-15-18-8-10-24(11-9-18)16-21-14-20-13-19(6-7-22(20)25-21)12-17-4-2-1-3-5-17/h1-7,13,18,21H,8-12,14,16H2