1-[2-methoxy-5-(2-methylbutan-2-yl)phenyl]-6-phenylmethoxy-1,2,3,4-tetrahydroisoquinoline

Systemtic Name: 1-[2-methoxy-5-(2-methylbutan-2-yl)phenyl]-6-phenylmethoxy-1,2,3,4-tetrahydroisoquinoline Openeye Name: 6-benzyloxy-1-[5-(1,1-dimethylpropyl)-2-methoxy-phenyl]-1,2,3,4-tetrahydroisoquinoline CAS Name: 1-[2-methoxy-5-(2-methylbutan-2-yl)phenyl]-6-phenylmethoxy-1,2,3,4-tetrahydroisoquinoline IUPAC Name: 1-[2-methoxy-5-(2-methylbutan-2-yl)phenyl]-6-phenylmethoxy-1,2,3,4-tetrahydroisoquinoline Traditional Name: 1-(5-tert-amyl-2-methoxy-phenyl)-6-benzoxy-1,2,3,4-tetrahydroisoquinoline Formula: C28H33NO2 MolecularWeight: 415.56712

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1=CC(=C(C=C1)OC)C2C3=C(CCN2)C=C(C=C3)OCC4=CC=CC=C4

Isomeric SMILES

CCC(C)(C)C1=CC(=C(C=C1)OC)C2C3=C(CCN2)C=C(C=C3)OCC4=CC=CC=C4

InChI

InChI=1S/C28H33NO2/c1-5-28(2,3)22-11-14-26(30-4)25(18-22)27-24-13-12-23(17-21(24)15-16-29-27)31-19-20-9-7-6-8-10-20/h6-14,17-18,27,29H,5,15-16,19H2,1-4H3