2-[3-(4-methylphenoxy)-3-phenyl-propyl]-3,4-dihydro-1H-isoquinoline-6,7-diol

Systemtic Name: 2-[3-(4-methylphenoxy)-3-phenyl-propyl]-3,4-dihydro-1H-isoquinoline-6,7-diol Openeye Name: 2-[3-(4-methylphenoxy)-3-phenyl-propyl]-3,4-dihydro-1H-isoquinoline-6,7-diol CAS Name: 2-[3-(4-methylphenoxy)-3-phenylpropyl]-3,4-dihydro-1H-isoquinoline-6,7-diol IUPAC Name: 2-[3-(4-methylphenoxy)-3-phenylpropyl]-3,4-dihydro-1H-isoquinoline-6,7-diol Traditional Name: 2-[3-(4-methylphenoxy)-3-phenyl-propyl]-3,4-dihydro-1H-isoquinoline-6,7-diol Formula: C25H27NO3 MolecularWeight: 389.48678

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OC(CCN2CCC3=CC(=C(C=C3C2)O)O)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)OC(CCN2CCC3=CC(=C(C=C3C2)O)O)C4=CC=CC=C4

InChI

InChI=1S/C25H27NO3/c1-18-7-9-22(10-8-18)29-25(19-5-3-2-4-6-19)12-14-26-13-11-20-15-23(27)24(28)16-21(20)17-26/h2-10,15-16,25,27-28H,11-14,17H2,1H3