1-(4-ethoxy-2-propan-2-yl-phenyl)-6-phenylmethoxy-1,2,3,4-tetrahydroisoquinoline

Systemtic Name: 1-(4-ethoxy-2-propan-2-yl-phenyl)-6-phenylmethoxy-1,2,3,4-tetrahydroisoquinoline Openeye Name: 6-benzyloxy-1-(4-ethoxy-2-isopropyl-phenyl)-1,2,3,4-tetrahydroisoquinoline CAS Name: 1-(4-ethoxy-2-propan-2-ylphenyl)-6-phenylmethoxy-1,2,3,4-tetrahydroisoquinoline IUPAC Name: 1-(4-ethoxy-2-propan-2-ylphenyl)-6-phenylmethoxy-1,2,3,4-tetrahydroisoquinoline Traditional Name: 6-benzoxy-1-(4-ethoxy-2-isopropyl-phenyl)-1,2,3,4-tetrahydroisoquinoline Formula: C27H31NO2 MolecularWeight: 401.54054

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H31NO2/c1-4-29-23-11-13-25(26(17-23)19(2)3)27-24-12-10-22(16-21(24)14-15-28-27)30-18-20-8-6-5-7-9-20/h5-13,16-17,19,27-28H,4,14-15,18H2,1-3H3