5-(4-chloranyl-2-methyl-phenoxy)-1-(6,7-dimethoxy-3,4-dihydroisoquinolin-1-yl)pentan-2-one

Systemtic Name: 5-(4-chloranyl-2-methyl-phenoxy)-1-(6,7-dimethoxy-3,4-dihydroisoquinolin-1-yl)pentan-2-one Openeye Name: 5-(4-chloro-2-methyl-phenoxy)-1-(6,7-dimethoxy-3,4-dihydroisoquinolin-1-yl)pentan-2-one CAS Name: 5-(4-chloro-2-methylphenoxy)-1-(6,7-dimethoxy-3,4-dihydroisoquinolin-1-yl)-2-pentanone IUPAC Name: 5-(4-chloro-2-methylphenoxy)-1-(6,7-dimethoxy-3,4-dihydroisoquinolin-1-yl)pentan-2-one Traditional Name: 5-(4-chloro-2-methyl-phenoxy)-1-(6,7-dimethoxy-3,4-dihydroisoquinolin-1-yl)pentan-2-one Formula: C23H26ClNO4 MolecularWeight: 415.90984

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Cl)OCCCC(=O)CC2=NCCC3=CC(=C(C=C32)OC)OC

Isomeric SMILES

CC1=C(C=CC(=C1)Cl)OCCCC(=O)CC2=NCCC3=CC(=C(C=C32)OC)OC

InChI

InChI=1S/C23H26ClNO4/c1-15-11-17(24)6-7-21(15)29-10-4-5-18(26)13-20-19-14-23(28-3)22(27-2)12-16(19)8-9-25-20/h6-7,11-12,14H,4-5,8-10,13H2,1-3H3