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

Systemtic Name: 1-(4,5-dimethoxy-2-nitro-phenyl)-5-ethoxy-6-methoxy-1,2,3,4-tetrahydroisoquinoline Openeye Name: 1-(4,5-dimethoxy-2-nitro-phenyl)-5-ethoxy-6-methoxy-1,2,3,4-tetrahydroisoquinoline CAS Name: 1-(4,5-dimethoxy-2-nitrophenyl)-5-ethoxy-6-methoxy-1,2,3,4-tetrahydroisoquinoline IUPAC Name: 1-(4,5-dimethoxy-2-nitrophenyl)-5-ethoxy-6-methoxy-1,2,3,4-tetrahydroisoquinoline Traditional Name: 1-(4,5-dimethoxy-2-nitro-phenyl)-5-ethoxy-6-methoxy-1,2,3,4-tetrahydroisoquinoline Formula: C20H24N2O6 MolecularWeight: 388.41436

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC2=C1CCNC2C3=CC(=C(C=C3[N+](=O)[O-])OC)OC)OC

Isomeric SMILES

CCOC1=C(C=CC2=C1CCNC2C3=CC(=C(C=C3[N+](=O)[O-])OC)OC)OC

InChI

InChI=1S/C20H24N2O6/c1-5-28-20-13-8-9-21-19(12(13)6-7-16(20)25-2)14-10-17(26-3)18(27-4)11-15(14)22(23)24/h6-7,10-11,19,21H,5,8-9H2,1-4H3