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

Systemtic Name: 1-(5-tert-butyl-4-methoxy-2-methyl-phenyl)-6-phenylmethoxy-1,2,3,4-tetrahydroisoquinoline Openeye Name: 6-benzyloxy-1-(5-tert-butyl-4-methoxy-2-methyl-phenyl)-1,2,3,4-tetrahydroisoquinoline CAS Name: 1-(5-tert-butyl-4-methoxy-2-methylphenyl)-6-phenylmethoxy-1,2,3,4-tetrahydroisoquinoline IUPAC Name: 1-(5-tert-butyl-4-methoxy-2-methylphenyl)-6-phenylmethoxy-1,2,3,4-tetrahydroisoquinoline Traditional Name: 6-benzoxy-1-(5-tert-butyl-4-methoxy-2-methyl-phenyl)-1,2,3,4-tetrahydroisoquinoline Formula: C28H33NO2 MolecularWeight: 415.56712

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C2C3=C(CCN2)C=C(C=C3)OCC4=CC=CC=C4)C(C)(C)C)OC

Isomeric SMILES

CC1=CC(=C(C=C1C2C3=C(CCN2)C=C(C=C3)OCC4=CC=CC=C4)C(C)(C)C)OC

InChI

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