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

Systemtic Name: 1-(2-bromanyl-5-methoxy-4-phenylmethoxy-phenyl)-6-ethoxy-1,2,3,4-tetrahydroisoquinoline Openeye Name: 1-(4-benzyloxy-2-bromo-5-methoxy-phenyl)-6-ethoxy-1,2,3,4-tetrahydroisoquinoline CAS Name: 1-(2-bromo-5-methoxy-4-phenylmethoxyphenyl)-6-ethoxy-1,2,3,4-tetrahydroisoquinoline IUPAC Name: 1-(2-bromo-5-methoxy-4-phenylmethoxyphenyl)-6-ethoxy-1,2,3,4-tetrahydroisoquinoline Traditional Name: 1-(4-benzoxy-2-bromo-5-methoxy-phenyl)-6-ethoxy-1,2,3,4-tetrahydroisoquinoline Formula: C25H26BrNO3 MolecularWeight: 468.38284

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)C(NCC2)C3=CC(=C(C=C3Br)OCC4=CC=CC=C4)OC

Isomeric SMILES

CCOC1=CC2=C(C=C1)C(NCC2)C3=CC(=C(C=C3Br)OCC4=CC=CC=C4)OC

InChI

InChI=1S/C25H26BrNO3/c1-3-29-19-9-10-20-18(13-19)11-12-27-25(20)21-14-23(28-2)24(15-22(21)26)30-16-17-7-5-4-6-8-17/h4-10,13-15,25,27H,3,11-12,16H2,1-2H3