1'-(phenylmethyl)spiro[4,5-dihydro-3H-2-benzoxepine-1,4'-piperidine]-3-carbonitrile

Systemtic Name: 1'-(phenylmethyl)spiro[4,5-dihydro-3H-2-benzoxepine-1,4'-piperidine]-3-carbonitrile Openeye Name: 1'-benzylspiro[4,5-dihydro-3H-2-benzoxepine-1,4'-piperidine]-3-carbonitrile CAS Name: 1'-(phenylmethyl)-3-spiro[4,5-dihydro-3H-2-benzoxepin-1,4'-piperidine]carbonitrile IUPAC Name: 1'-benzylspiro[4,5-dihydro-3H-2-benzoxepine-1,4'-piperidine]-3-carbonitrile Traditional Name: 1'-benzylspiro[4,5-dihydro-3H-2-benzoxepin-1,4'-piperidine]-3-carbonitrile Formula: C22H24N2O MolecularWeight: 332.43876

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=CC=CC=C2C3(CCN(CC3)CC4=CC=CC=C4)OC1C#N

Isomeric SMILES

C1CC2=CC=CC=C2C3(CCN(CC3)CC4=CC=CC=C4)OC1C#N

InChI

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