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

Systemtic Name: 1-[3-(3-methylbutoxy)phenyl]-6-phenylmethoxy-1,2,3,4-tetrahydroisoquinoline Openeye Name: 6-benzyloxy-1-(3-isopentyloxyphenyl)-1,2,3,4-tetrahydroisoquinoline CAS Name: 1-[3-(3-methylbutoxy)phenyl]-6-phenylmethoxy-1,2,3,4-tetrahydroisoquinoline IUPAC Name: 1-[3-(3-methylbutoxy)phenyl]-6-phenylmethoxy-1,2,3,4-tetrahydroisoquinoline Traditional Name: 6-benzoxy-1-(3-isoamoxyphenyl)-1,2,3,4-tetrahydroisoquinoline Formula: C27H31NO2 MolecularWeight: 401.54054

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC1=CC=CC(=C1)C2C3=C(CCN2)C=C(C=C3)OCC4=CC=CC=C4

Isomeric SMILES

CC(C)CCOC1=CC=CC(=C1)C2C3=C(CCN2)C=C(C=C3)OCC4=CC=CC=C4

InChI

InChI=1S/C27H31NO2/c1-20(2)14-16-29-24-10-6-9-23(18-24)27-26-12-11-25(17-22(26)13-15-28-27)30-19-21-7-4-3-5-8-21/h3-12,17-18,20,27-28H,13-16,19H2,1-2H3