1-(4,5-dimethoxy-2-nitro-phenyl)-6-methoxy-7-phenylmethoxy-1,2,3,4-tetrahydroisoquinoline

Systemtic Name: 1-(4,5-dimethoxy-2-nitro-phenyl)-6-methoxy-7-phenylmethoxy-1,2,3,4-tetrahydroisoquinoline Openeye Name: 7-benzyloxy-1-(4,5-dimethoxy-2-nitro-phenyl)-6-methoxy-1,2,3,4-tetrahydroisoquinoline CAS Name: 1-(4,5-dimethoxy-2-nitrophenyl)-6-methoxy-7-phenylmethoxy-1,2,3,4-tetrahydroisoquinoline IUPAC Name: 1-(4,5-dimethoxy-2-nitrophenyl)-6-methoxy-7-phenylmethoxy-1,2,3,4-tetrahydroisoquinoline Traditional Name: 7-benzoxy-1-(4,5-dimethoxy-2-nitro-phenyl)-6-methoxy-1,2,3,4-tetrahydroisoquinoline Formula: C25H26N2O6 MolecularWeight: 450.48374

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(NCCC2=C1)C3=CC(=C(C=C3[N+](=O)[O-])OC)OC)OCC4=CC=CC=C4

Isomeric SMILES

COC1=C(C=C2C(NCCC2=C1)C3=CC(=C(C=C3[N+](=O)[O-])OC)OC)OCC4=CC=CC=C4

InChI

InChI=1S/C25H26N2O6/c1-30-21-11-17-9-10-26-25(18(17)12-24(21)33-15-16-7-5-4-6-8-16)19-13-22(31-2)23(32-3)14-20(19)27(28)29/h4-8,11-14,25-26H,9-10,15H2,1-3H3