1-(3-tert-butyl-4-methoxy-phenyl)-6-methoxy-7-phenylmethoxy-1,2,3,4-tetrahydroisoquinoline

Systemtic Name: 1-(3-tert-butyl-4-methoxy-phenyl)-6-methoxy-7-phenylmethoxy-1,2,3,4-tetrahydroisoquinoline Openeye Name: 7-benzyloxy-1-(3-tert-butyl-4-methoxy-phenyl)-6-methoxy-1,2,3,4-tetrahydroisoquinoline CAS Name: 1-(3-tert-butyl-4-methoxyphenyl)-6-methoxy-7-phenylmethoxy-1,2,3,4-tetrahydroisoquinoline IUPAC Name: 1-(3-tert-butyl-4-methoxyphenyl)-6-methoxy-7-phenylmethoxy-1,2,3,4-tetrahydroisoquinoline Traditional Name: 7-benzoxy-1-(3-tert-butyl-4-methoxy-phenyl)-6-methoxy-1,2,3,4-tetrahydroisoquinoline Formula: C28H33NO3 MolecularWeight: 431.56652

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C(C=CC(=C1)C2C3=CC(=C(C=C3CCN2)OC)OCC4=CC=CC=C4)OC

Isomeric SMILES

CC(C)(C)C1=C(C=CC(=C1)C2C3=CC(=C(C=C3CCN2)OC)OCC4=CC=CC=C4)OC

InChI

InChI=1S/C28H33NO3/c1-28(2,3)23-15-21(11-12-24(23)30-4)27-22-17-26(32-18-19-9-7-6-8-10-19)25(31-5)16-20(22)13-14-29-27/h6-12,15-17,27,29H,13-14,18H2,1-5H3