6-methoxy-1-[3-(3-methylbutoxy)phenyl]-7-phenylmethoxy-1,2,3,4-tetrahydroisoquinoline

Systemtic Name: 6-methoxy-1-[3-(3-methylbutoxy)phenyl]-7-phenylmethoxy-1,2,3,4-tetrahydroisoquinoline Openeye Name: 7-benzyloxy-1-(3-isopentyloxyphenyl)-6-methoxy-1,2,3,4-tetrahydroisoquinoline CAS Name: 6-methoxy-1-[3-(3-methylbutoxy)phenyl]-7-phenylmethoxy-1,2,3,4-tetrahydroisoquinoline IUPAC Name: 6-methoxy-1-[3-(3-methylbutoxy)phenyl]-7-phenylmethoxy-1,2,3,4-tetrahydroisoquinoline Traditional Name: 7-benzoxy-1-(3-isoamoxyphenyl)-6-methoxy-1,2,3,4-tetrahydroisoquinoline Formula: C28H33NO3 MolecularWeight: 431.56652

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC1=CC=CC(=C1)C2C3=CC(=C(C=C3CCN2)OC)OCC4=CC=CC=C4

Isomeric SMILES

CC(C)CCOC1=CC=CC(=C1)C2C3=CC(=C(C=C3CCN2)OC)OCC4=CC=CC=C4

InChI

InChI=1S/C28H33NO3/c1-20(2)13-15-31-24-11-7-10-23(16-24)28-25-18-27(32-19-21-8-5-4-6-9-21)26(30-3)17-22(25)12-14-29-28/h4-11,16-18,20,28-29H,12-15,19H2,1-3H3