(2S)-1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-(2,4,6-trimethylphenoxy)propan-2-ol

Systemtic Name: (2S)-1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-(2,4,6-trimethylphenoxy)propan-2-ol Openeye Name: (2S)-1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-(2,4,6-trimethylphenoxy)propan-2-ol CAS Name: (2S)-1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-(2,4,6-trimethylphenoxy)-2-propanol IUPAC Name: (2S)-1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-(2,4,6-trimethylphenoxy)propan-2-ol Traditional Name: (2S)-1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-(2,4,6-trimethylphenoxy)propan-2-ol Formula: C21H27NO2 MolecularWeight: 325.44458

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)OCC(CN2CCC3=CC=CC=C3C2)O)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)OC[C@H](CN2CCC3=CC=CC=C3C2)O)C

InChI

InChI=1S/C21H27NO2/c1-15-10-16(2)21(17(3)11-15)24-14-20(23)13-22-9-8-18-6-4-5-7-19(18)12-22/h4-7,10-11,20,23H,8-9,12-14H2,1-3H3/t20-/m0/s1