1-(phenylmethyl)-3,3a,4,5,6,7-hexahydro-2H-indole-7a-carbonitrile

Systemtic Name: 1-(phenylmethyl)-3,3a,4,5,6,7-hexahydro-2H-indole-7a-carbonitrile Openeye Name: 1-benzyl-3,3a,4,5,6,7-hexahydro-2H-indole-7a-carbonitrile CAS Name: 1-(phenylmethyl)-3,3a,4,5,6,7-hexahydro-2H-indole-7a-carbonitrile IUPAC Name: 1-benzyl-3,3a,4,5,6,7-hexahydro-2H-indole-7a-carbonitrile Traditional Name: 1-benzyl-3,3a,4,5,6,7-hexahydro-2H-indole-7a-carbonitrile Formula: C16H20N2 MolecularWeight: 240.3434

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2(C(C1)CCN2CC3=CC=CC=C3)C#N

Isomeric SMILES

C1CCC2(C(C1)CCN2CC3=CC=CC=C3)C#N

InChI

InChI=1S/C16H20N2/c17-13-16-10-5-4-8-15(16)9-11-18(16)12-14-6-2-1-3-7-14/h1-3,6-7,15H,4-5,8-12H2