1-(2-ethoxy-4,5-dimethyl-phenyl)-6-methoxy-7-phenylmethoxy-1,2,3,4-tetrahydroisoquinoline

Systemtic Name: 1-(2-ethoxy-4,5-dimethyl-phenyl)-6-methoxy-7-phenylmethoxy-1,2,3,4-tetrahydroisoquinoline Openeye Name: 7-benzyloxy-1-(2-ethoxy-4,5-dimethyl-phenyl)-6-methoxy-1,2,3,4-tetrahydroisoquinoline CAS Name: 1-(2-ethoxy-4,5-dimethylphenyl)-6-methoxy-7-phenylmethoxy-1,2,3,4-tetrahydroisoquinoline IUPAC Name: 1-(2-ethoxy-4,5-dimethylphenyl)-6-methoxy-7-phenylmethoxy-1,2,3,4-tetrahydroisoquinoline Traditional Name: 7-benzoxy-1-(2-ethoxy-4,5-dimethyl-phenyl)-6-methoxy-1,2,3,4-tetrahydroisoquinoline Formula: C27H31NO3 MolecularWeight: 417.53994

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C(C=C1C2C3=CC(=C(C=C3CCN2)OC)OCC4=CC=CC=C4)C)C

Isomeric SMILES

CCOC1=CC(=C(C=C1C2C3=CC(=C(C=C3CCN2)OC)OCC4=CC=CC=C4)C)C

InChI

InChI=1S/C27H31NO3/c1-5-30-24-14-19(3)18(2)13-23(24)27-22-16-26(31-17-20-9-7-6-8-10-20)25(29-4)15-21(22)11-12-28-27/h6-10,13-16,27-28H,5,11-12,17H2,1-4H3