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

Systemtic Name: 1-(4-tert-butylphenyl)-6-methoxy-7-phenylmethoxy-1,2,3,4-tetrahydroisoquinoline Openeye Name: 7-benzyloxy-1-(4-tert-butylphenyl)-6-methoxy-1,2,3,4-tetrahydroisoquinoline CAS Name: 1-(4-tert-butylphenyl)-6-methoxy-7-phenylmethoxy-1,2,3,4-tetrahydroisoquinoline IUPAC Name: 1-(4-tert-butylphenyl)-6-methoxy-7-phenylmethoxy-1,2,3,4-tetrahydroisoquinoline Traditional Name: 7-benzoxy-1-(4-tert-butylphenyl)-6-methoxy-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)C2C3=CC(=C(C=C3CCN2)OC)OCC4=CC=CC=C4

Isomeric SMILES

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

InChI

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