1-(5-tert-butyl-2-methoxy-phenyl)-6-phenylmethoxy-1,2,3,4-tetrahydroisoquinoline

Systemtic Name: 1-(5-tert-butyl-2-methoxy-phenyl)-6-phenylmethoxy-1,2,3,4-tetrahydroisoquinoline Openeye Name: 6-benzyloxy-1-(5-tert-butyl-2-methoxy-phenyl)-1,2,3,4-tetrahydroisoquinoline CAS Name: 1-(5-tert-butyl-2-methoxyphenyl)-6-phenylmethoxy-1,2,3,4-tetrahydroisoquinoline IUPAC Name: 1-(5-tert-butyl-2-methoxyphenyl)-6-phenylmethoxy-1,2,3,4-tetrahydroisoquinoline Traditional Name: 6-benzoxy-1-(5-tert-butyl-2-methoxy-phenyl)-1,2,3,4-tetrahydroisoquinoline Formula: C27H31NO2 MolecularWeight: 401.54054

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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