1-[(6-chloranyl-1,3-benzodioxol-5-yl)methyl]-6-methoxy-7-phenylmethoxy-1,2,3,4-tetrahydroisoquinoline

Systemtic Name: 1-[(6-chloranyl-1,3-benzodioxol-5-yl)methyl]-6-methoxy-7-phenylmethoxy-1,2,3,4-tetrahydroisoquinoline Openeye Name: 7-benzyloxy-1-[(6-chloro-1,3-benzodioxol-5-yl)methyl]-6-methoxy-1,2,3,4-tetrahydroisoquinoline CAS Name: 1-[(6-chloro-1,3-benzodioxol-5-yl)methyl]-6-methoxy-7-phenylmethoxy-1,2,3,4-tetrahydroisoquinoline IUPAC Name: 1-[(6-chloro-1,3-benzodioxol-5-yl)methyl]-6-methoxy-7-phenylmethoxy-1,2,3,4-tetrahydroisoquinoline Traditional Name: 7-benzoxy-1-[(6-chloro-1,3-benzodioxol-5-yl)methyl]-6-methoxy-1,2,3,4-tetrahydroisoquinoline Formula: C25H24ClNO4 MolecularWeight: 437.91536

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(NCCC2=C1)CC3=CC4=C(C=C3Cl)OCO4)OCC5=CC=CC=C5

Isomeric SMILES

COC1=C(C=C2C(NCCC2=C1)CC3=CC4=C(C=C3Cl)OCO4)OCC5=CC=CC=C5

InChI

InChI=1S/C25H24ClNO4/c1-28-22-10-17-7-8-27-21(9-18-11-23-25(13-20(18)26)31-15-30-23)19(17)12-24(22)29-14-16-5-3-2-4-6-16/h2-6,10-13,21,27H,7-9,14-15H2,1H3