2-(phenylmethyl)-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinoline-3-carbonitrile

Systemtic Name: 2-(phenylmethyl)-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinoline-3-carbonitrile Openeye Name: 2-benzyl-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinoline-3-carbonitrile CAS Name: 2-(phenylmethyl)-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinoline-3-carbonitrile IUPAC Name: 2-benzyl-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinoline-3-carbonitrile Traditional Name: 2-benzyl-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinoline-3-carbonitrile Formula: C17H22N2 MolecularWeight: 254.36998

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2CN(C(CC2C1)C#N)CC3=CC=CC=C3

Isomeric SMILES

C1CCC2CN(C(CC2C1)C#N)CC3=CC=CC=C3

InChI

InChI=1S/C17H22N2/c18-11-17-10-15-8-4-5-9-16(15)13-19(17)12-14-6-2-1-3-7-14/h1-3,6-7,15-17H,4-5,8-10,12-13H2