(4aS,6S)-2-ethyl-4a-(3-methoxyphenyl)-6-methyl-4,5,6,7-tetrahydro-3H-isoquinolin-1-one

Systemtic Name: (4aS,6S)-2-ethyl-4a-(3-methoxyphenyl)-6-methyl-4,5,6,7-tetrahydro-3H-isoquinolin-1-one Openeye Name: (4aS,6S)-2-ethyl-4a-(3-methoxyphenyl)-6-methyl-4,5,6,7-tetrahydro-3H-isoquinolin-1-one CAS Name: (4aS,6S)-2-ethyl-4a-(3-methoxyphenyl)-6-methyl-4,5,6,7-tetrahydro-3H-isoquinolin-1-one IUPAC Name: (4aS,6S)-2-ethyl-4a-(3-methoxyphenyl)-6-methyl-4,5,6,7-tetrahydro-3H-isoquinolin-1-one Traditional Name: (4aS,6S)-2-ethyl-4a-(3-methoxyphenyl)-6-methyl-4,5,6,7-tetrahydro-3H-isoquinolin-1-one Formula: C19H25NO2 MolecularWeight: 299.4073

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCC2(CC(CC=C2C1=O)C)C3=CC(=CC=C3)OC

Isomeric SMILES

CCN1CC[C@@]2(C[C@H](CC=C2C1=O)C)C3=CC(=CC=C3)OC

InChI

InChI=1S/C19H25NO2/c1-4-20-11-10-19(15-6-5-7-16(12-15)22-3)13-14(2)8-9-17(19)18(20)21/h5-7,9,12,14H,4,8,10-11,13H2,1-3H3/t14-,19+/m0/s1