1-ethynyl-2-(phenylmethyl)-3,4-dihydro-1H-isoquinoline

Systemtic Name: 1-ethynyl-2-(phenylmethyl)-3,4-dihydro-1H-isoquinoline Openeye Name: 2-benzyl-1-ethynyl-3,4-dihydro-1H-isoquinoline CAS Name: 1-ethynyl-2-(phenylmethyl)-3,4-dihydro-1H-isoquinoline IUPAC Name: 2-benzyl-1-ethynyl-3,4-dihydro-1H-isoquinoline Traditional Name: 2-benzyl-1-ethynyl-3,4-dihydro-1H-isoquinoline Formula: C18H17N MolecularWeight: 247.33428

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Descriptors Computed from Structure

Canonical SMILES:

C#CC1C2=CC=CC=C2CCN1CC3=CC=CC=C3

Isomeric SMILES

C#CC1C2=CC=CC=C2CCN1CC3=CC=CC=C3

InChI

InChI=1S/C18H17N/c1-2-18-17-11-7-6-10-16(17)12-13-19(18)14-15-8-4-3-5-9-15/h1,3-11,18H,12-14H2