6,7-diethoxy-1-(4-phenylmethoxyphenyl)-1,2,3,4-tetrahydroisoquinoline

Systemtic Name: 6,7-diethoxy-1-(4-phenylmethoxyphenyl)-1,2,3,4-tetrahydroisoquinoline Openeye Name: 1-(4-benzyloxyphenyl)-6,7-diethoxy-1,2,3,4-tetrahydroisoquinoline CAS Name: 6,7-diethoxy-1-(4-phenylmethoxyphenyl)-1,2,3,4-tetrahydroisoquinoline IUPAC Name: 6,7-diethoxy-1-(4-phenylmethoxyphenyl)-1,2,3,4-tetrahydroisoquinoline Traditional Name: 1-(4-benzoxyphenyl)-6,7-diethoxy-1,2,3,4-tetrahydroisoquinoline Formula: C26H29NO3 MolecularWeight: 403.51336

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(NCCC2=C1)C3=CC=C(C=C3)OCC4=CC=CC=C4)OCC

Isomeric SMILES

CCOC1=C(C=C2C(NCCC2=C1)C3=CC=C(C=C3)OCC4=CC=CC=C4)OCC

InChI

InChI=1S/C26H29NO3/c1-3-28-24-16-21-14-15-27-26(23(21)17-25(24)29-4-2)20-10-12-22(13-11-20)30-18-19-8-6-5-7-9-19/h5-13,16-17,26-27H,3-4,14-15,18H2,1-2H3