(1R,4aR)-6-methoxy-1-[(4-methoxy-3-oxidanyl-phenyl)methyl]-2-methyl-1,3,4,4a-tetrahydroisoquinolin-7-one

Systemtic Name: (1R,4aR)-6-methoxy-1-[(4-methoxy-3-oxidanyl-phenyl)methyl]-2-methyl-1,3,4,4a-tetrahydroisoquinolin-7-one Openeye Name: (1R,4aR)-1-[(3-hydroxy-4-methoxy-phenyl)methyl]-6-methoxy-2-methyl-1,3,4,4a-tetrahydroisoquinolin-7-one CAS Name: (1R,4aR)-1-[(3-hydroxy-4-methoxyphenyl)methyl]-6-methoxy-2-methyl-1,3,4,4a-tetrahydroisoquinolin-7-one IUPAC Name: (1R,4aR)-1-[(3-hydroxy-4-methoxyphenyl)methyl]-6-methoxy-2-methyl-1,3,4,4a-tetrahydroisoquinolin-7-one Traditional Name: (1R,4aR)-1-(3-hydroxy-4-methoxy-benzyl)-6-methoxy-2-methyl-1,3,4,4a-tetrahydroisoquinolin-7-one Formula: C19H23NO4 MolecularWeight: 329.39022

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC2C=C(C(=O)C=C2C1CC3=CC(=C(C=C3)OC)O)OC

Isomeric SMILES

CN1CC[C@@H]2C=C(C(=O)C=C2[C@H]1CC3=CC(=C(C=C3)OC)O)OC

InChI

InChI=1S/C19H23NO4/c1-20-7-6-13-10-19(24-3)17(22)11-14(13)15(20)8-12-4-5-18(23-2)16(21)9-12/h4-5,9-11,13,15,21H,6-8H2,1-3H3/t13-,15-/m1/s1