3,3-dimethyl-1-(phenylmethyl)-4H-isoquinoline

Systemtic Name: 3,3-dimethyl-1-(phenylmethyl)-4H-isoquinoline Openeye Name: 1-benzyl-3,3-dimethyl-4H-isoquinoline CAS Name: 3,3-dimethyl-1-(phenylmethyl)-4H-isoquinoline IUPAC Name: 1-benzyl-3,3-dimethyl-4H-isoquinoline Traditional Name: 1-benzyl-3,3-dimethyl-4H-isoquinoline Formula: C18H19N MolecularWeight: 249.35016

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=CC=CC=C2C(=N1)CC3=CC=CC=C3)C

Isomeric SMILES

CC1(CC2=CC=CC=C2C(=N1)CC3=CC=CC=C3)C

InChI

InChI=1S/C18H19N/c1-18(2)13-15-10-6-7-11-16(15)17(19-18)12-14-8-4-3-5-9-14/h3-11H,12-13H2,1-2H3