6,7-diethoxy-1-(3-phenoxyphenyl)-1,2,3,4-tetrahydroisoquinoline

Systemtic Name: 6,7-diethoxy-1-(3-phenoxyphenyl)-1,2,3,4-tetrahydroisoquinoline Openeye Name: 6,7-diethoxy-1-(3-phenoxyphenyl)-1,2,3,4-tetrahydroisoquinoline CAS Name: 6,7-diethoxy-1-(3-phenoxyphenyl)-1,2,3,4-tetrahydroisoquinoline IUPAC Name: 6,7-diethoxy-1-(3-phenoxyphenyl)-1,2,3,4-tetrahydroisoquinoline Traditional Name: 6,7-diethoxy-1-(3-phenoxyphenyl)-1,2,3,4-tetrahydroisoquinoline Formula: C25H27NO3 MolecularWeight: 389.48678

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(NCCC2=C1)C3=CC(=CC=C3)OC4=CC=CC=C4)OCC

Isomeric SMILES

CCOC1=C(C=C2C(NCCC2=C1)C3=CC(=CC=C3)OC4=CC=CC=C4)OCC

InChI

InChI=1S/C25H27NO3/c1-3-27-23-16-18-13-14-26-25(22(18)17-24(23)28-4-2)19-9-8-12-21(15-19)29-20-10-6-5-7-11-20/h5-12,15-17,25-26H,3-4,13-14H2,1-2H3