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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=C(C=C1)C2C3=CC(=C(C=C3CCN2)OC)OCC4=CC=CC=C4

Isomeric SMILES

CCCCCOC1=CC=C(C=C1)C2C3=CC(=C(C=C3CCN2)OC)OCC4=CC=CC=C4

InChI

InChI=1S/C28H33NO3/c1-3-4-8-17-31-24-13-11-22(12-14-24)28-25-19-27(32-20-21-9-6-5-7-10-21)26(30-2)18-23(25)15-16-29-28/h5-7,9-14,18-19,28-29H,3-4,8,15-17,20H2,1-2H3