1-[(E)-2-(4-chlorophenyl)ethenyl]-3-methyl-6-(2-methylpropoxy)-3,4-dihydroisoquinoline

Systemtic Name: 1-[(E)-2-(4-chlorophenyl)ethenyl]-3-methyl-6-(2-methylpropoxy)-3,4-dihydroisoquinoline Openeye Name: 1-[(E)-2-(4-chlorophenyl)vinyl]-6-isobutoxy-3-methyl-3,4-dihydroisoquinoline CAS Name: 1-[(E)-2-(4-chlorophenyl)ethenyl]-3-methyl-6-(2-methylpropoxy)-3,4-dihydroisoquinoline IUPAC Name: 1-[(E)-2-(4-chlorophenyl)ethenyl]-3-methyl-6-(2-methylpropoxy)-3,4-dihydroisoquinoline Traditional Name: 1-[(E)-2-(4-chlorophenyl)vinyl]-6-isobutoxy-3-methyl-3,4-dihydroisoquinoline Formula: C22H24ClNO MolecularWeight: 353.88506

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=C(C=CC(=C2)OCC(C)C)C(=N1)C=CC3=CC=C(C=C3)Cl

Isomeric SMILES

CC1CC2=C(C=CC(=C2)OCC(C)C)C(=N1)/C=C/C3=CC=C(C=C3)Cl

InChI

InChI=1S/C22H24ClNO/c1-15(2)14-25-20-9-10-21-18(13-20)12-16(3)24-22(21)11-6-17-4-7-19(23)8-5-17/h4-11,13,15-16H,12,14H2,1-3H3/b11-6+