(E)-3-[(1S)-7-methoxy-1-methyl-6-oxidanyl-3,4-dihydro-1H-isoquinolin-2-yl]-1-(4-methoxyphenyl)prop-2-en-1-one

Systemtic Name: (E)-3-[(1S)-7-methoxy-1-methyl-6-oxidanyl-3,4-dihydro-1H-isoquinolin-2-yl]-1-(4-methoxyphenyl)prop-2-en-1-one Openeye Name: (E)-3-[(1S)-6-hydroxy-7-methoxy-1-methyl-3,4-dihydro-1H-isoquinolin-2-yl]-1-(4-methoxyphenyl)prop-2-en-1-one CAS Name: (E)-3-[(1S)-6-hydroxy-7-methoxy-1-methyl-3,4-dihydro-1H-isoquinolin-2-yl]-1-(4-methoxyphenyl)-2-propen-1-one IUPAC Name: (E)-3-[(1S)-6-hydroxy-7-methoxy-1-methyl-3,4-dihydro-1H-isoquinolin-2-yl]-1-(4-methoxyphenyl)prop-2-en-1-one Traditional Name: (E)-3-[(1S)-6-hydroxy-7-methoxy-1-methyl-3,4-dihydro-1H-isoquinolin-2-yl]-1-(4-methoxyphenyl)prop-2-en-1-one Formula: C21H23NO4 MolecularWeight: 353.41162

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1C2=CC(=C(C=C2CCN1C=CC(=O)C3=CC=C(C=C3)OC)O)OC

Isomeric SMILES

C[C@H]1C2=CC(=C(C=C2CCN1/C=C/C(=O)C3=CC=C(C=C3)OC)O)OC

InChI

InChI=1S/C21H23NO4/c1-14-18-13-21(26-3)20(24)12-16(18)8-10-22(14)11-9-19(23)15-4-6-17(25-2)7-5-15/h4-7,9,11-14,24H,8,10H2,1-3H3/b11-9+/t14-/m0/s1