6,7-diethoxy-1-[3-(3-methylbutoxy)phenyl]-1,2,3,4-tetrahydroisoquinoline

Systemtic Name: 6,7-diethoxy-1-[3-(3-methylbutoxy)phenyl]-1,2,3,4-tetrahydroisoquinoline Openeye Name: 6,7-diethoxy-1-(3-isopentyloxyphenyl)-1,2,3,4-tetrahydroisoquinoline CAS Name: 6,7-diethoxy-1-[3-(3-methylbutoxy)phenyl]-1,2,3,4-tetrahydroisoquinoline IUPAC Name: 6,7-diethoxy-1-[3-(3-methylbutoxy)phenyl]-1,2,3,4-tetrahydroisoquinoline Traditional Name: 6,7-diethoxy-1-(3-isoamoxyphenyl)-1,2,3,4-tetrahydroisoquinoline Formula: C24H33NO3 MolecularWeight: 383.52372

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(NCCC2=C1)C3=CC(=CC=C3)OCCC(C)C)OCC

Isomeric SMILES

CCOC1=C(C=C2C(NCCC2=C1)C3=CC(=CC=C3)OCCC(C)C)OCC

InChI

InChI=1S/C24H33NO3/c1-5-26-22-15-18-10-12-25-24(21(18)16-23(22)27-6-2)19-8-7-9-20(14-19)28-13-11-17(3)4/h7-9,14-17,24-25H,5-6,10-13H2,1-4H3