(4aR,8aR)-7,8a-dimethyl-2-(phenylmethyl)-1,3,4,4a-tetrahydroisoquinoline-5-carbaldehyde

Systemtic Name: (4aR,8aR)-7,8a-dimethyl-2-(phenylmethyl)-1,3,4,4a-tetrahydroisoquinoline-5-carbaldehyde Openeye Name: (4aR,8aR)-2-benzyl-7,8a-dimethyl-1,3,4,4a-tetrahydroisoquinoline-5-carbaldehyde CAS Name: (4aR,8aR)-7,8a-dimethyl-2-(phenylmethyl)-1,3,4,4a-tetrahydroisoquinoline-5-carboxaldehyde IUPAC Name: (4aR,8aR)-2-benzyl-7,8a-dimethyl-1,3,4,4a-tetrahydroisoquinoline-5-carbaldehyde Traditional Name: (4aR,8aR)-2-benzyl-7,8a-dimethyl-1,3,4,4a-tetrahydroisoquinoline-5-carbaldehyde Formula: C19H23NO MolecularWeight: 281.39202

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2(CN(CCC2C(=C1)C=O)CC3=CC=CC=C3)C

Isomeric SMILES

CC1=C[C@]2(CN(CC[C@H]2C(=C1)C=O)CC3=CC=CC=C3)C

InChI

InChI=1S/C19H23NO/c1-15-10-17(13-21)18-8-9-20(14-19(18,2)11-15)12-16-6-4-3-5-7-16/h3-7,10-11,13,18H,8-9,12,14H2,1-2H3/t18-,19-/m0/s1