1-(4-ethoxy-2-propan-2-yl-phenyl)-6-methoxy-7-phenylmethoxy-1,2,3,4-tetrahydroisoquinoline

Systemtic Name: 1-(4-ethoxy-2-propan-2-yl-phenyl)-6-methoxy-7-phenylmethoxy-1,2,3,4-tetrahydroisoquinoline Openeye Name: 7-benzyloxy-1-(4-ethoxy-2-isopropyl-phenyl)-6-methoxy-1,2,3,4-tetrahydroisoquinoline CAS Name: 1-(4-ethoxy-2-propan-2-ylphenyl)-6-methoxy-7-phenylmethoxy-1,2,3,4-tetrahydroisoquinoline IUPAC Name: 1-(4-ethoxy-2-propan-2-ylphenyl)-6-methoxy-7-phenylmethoxy-1,2,3,4-tetrahydroisoquinoline Traditional Name: 7-benzoxy-1-(4-ethoxy-2-isopropyl-phenyl)-6-methoxy-1,2,3,4-tetrahydroisoquinoline Formula: C28H33NO3 MolecularWeight: 431.56652

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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