2-[(4-butoxyphenyl)methyl]-1-(3-chlorophenyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline

Systemtic Name: 2-[(4-butoxyphenyl)methyl]-1-(3-chlorophenyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline Openeye Name: 2-[(4-butoxyphenyl)methyl]-1-(3-chlorophenyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline CAS Name: 2-[(4-butoxyphenyl)methyl]-1-(3-chlorophenyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline IUPAC Name: 2-[(4-butoxyphenyl)methyl]-1-(3-chlorophenyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline Traditional Name: 2-(4-butoxybenzyl)-1-(3-chlorophenyl)-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline Formula: C28H32ClNO3 MolecularWeight: 466.01158

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)CN2CCC3=CC(=C(C=C3C2C4=CC(=CC=C4)Cl)OC)OC

Isomeric SMILES

CCCCOC1=CC=C(C=C1)CN2CCC3=CC(=C(C=C3C2C4=CC(=CC=C4)Cl)OC)OC

InChI

InChI=1S/C28H32ClNO3/c1-4-5-15-33-24-11-9-20(10-12-24)19-30-14-13-21-17-26(31-2)27(32-3)18-25(21)28(30)22-7-6-8-23(29)16-22/h6-12,16-18,28H,4-5,13-15,19H2,1-3H3