3-[(1S)-1-(2-hydroxyethyl)-6-methoxy-3,4-dihydro-1H-isoquinolin-2-yl]-2-methyl-cyclopent-2-en-1-one

Systemtic Name: 3-[(1S)-1-(2-hydroxyethyl)-6-methoxy-3,4-dihydro-1H-isoquinolin-2-yl]-2-methyl-cyclopent-2-en-1-one Openeye Name: 3-[(1S)-1-(2-hydroxyethyl)-6-methoxy-3,4-dihydro-1H-isoquinolin-2-yl]-2-methyl-cyclopent-2-en-1-one CAS Name: 3-[(1S)-1-(2-hydroxyethyl)-6-methoxy-3,4-dihydro-1H-isoquinolin-2-yl]-2-methyl-1-cyclopent-2-enone IUPAC Name: 3-[(1S)-1-(2-hydroxyethyl)-6-methoxy-3,4-dihydro-1H-isoquinolin-2-yl]-2-methylcyclopent-2-en-1-one Traditional Name: 3-[(1S)-1-(2-hydroxyethyl)-6-methoxy-3,4-dihydro-1H-isoquinolin-2-yl]-2-methyl-cyclopent-2-en-1-one Formula: C18H23NO3 MolecularWeight: 301.38012

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(CCC1=O)N2CCC3=C(C2CCO)C=CC(=C3)OC

Isomeric SMILES

CC1=C(CCC1=O)N2CCC3=C([C@@H]2CCO)C=CC(=C3)OC

InChI

InChI=1S/C18H23NO3/c1-12-16(5-6-18(12)21)19-9-7-13-11-14(22-2)3-4-15(13)17(19)8-10-20/h3-4,11,17,20H,5-10H2,1-2H3/t17-/m0/s1