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

Systemtic Name: 1-[3-(3-methylbutoxy)phenyl]-1,2,3,4-tetrahydroisoquinoline-6,7-diol Openeye Name: 1-(3-isopentyloxyphenyl)-1,2,3,4-tetrahydroisoquinoline-6,7-diol CAS Name: 1-[3-(3-methylbutoxy)phenyl]-1,2,3,4-tetrahydroisoquinoline-6,7-diol IUPAC Name: 1-[3-(3-methylbutoxy)phenyl]-1,2,3,4-tetrahydroisoquinoline-6,7-diol Traditional Name: 1-(3-isoamoxyphenyl)-1,2,3,4-tetrahydroisoquinoline-6,7-diol Formula: C20H25NO3 MolecularWeight: 327.4174

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC1=CC=CC(=C1)C2C3=CC(=C(C=C3CCN2)O)O

Isomeric SMILES

CC(C)CCOC1=CC=CC(=C1)C2C3=CC(=C(C=C3CCN2)O)O

InChI

InChI=1S/C20H25NO3/c1-13(2)7-9-24-16-5-3-4-15(10-16)20-17-12-19(23)18(22)11-14(17)6-8-21-20/h3-5,10-13,20-23H,6-9H2,1-2H3