1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-4-(3-methylphenoxy)butan-1-one

Systemtic Name: 1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-4-(3-methylphenoxy)butan-1-one Openeye Name: 1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-4-(3-methylphenoxy)butan-1-one CAS Name: 1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-4-(3-methylphenoxy)-1-butanone IUPAC Name: 1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-4-(3-methylphenoxy)butan-1-one Traditional Name: 1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-4-(3-methylphenoxy)butan-1-one Formula: C22H27NO4 MolecularWeight: 369.45408

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCCCC(=O)N2CCC3=CC(=C(C=C3C2)OC)OC

Isomeric SMILES

CC1=CC(=CC=C1)OCCCC(=O)N2CCC3=CC(=C(C=C3C2)OC)OC

InChI

InChI=1S/C22H27NO4/c1-16-6-4-7-19(12-16)27-11-5-8-22(24)23-10-9-17-13-20(25-2)21(26-3)14-18(17)15-23/h4,6-7,12-14H,5,8-11,15H2,1-3H3