6,7-dimethoxy-2-[3-(3-methoxy-4-nitro-phenoxy)propyl]-3,4-dihydro-1H-isoquinoline

Systemtic Name: 6,7-dimethoxy-2-[3-(3-methoxy-4-nitro-phenoxy)propyl]-3,4-dihydro-1H-isoquinoline Openeye Name: 6,7-dimethoxy-2-[3-(3-methoxy-4-nitro-phenoxy)propyl]-3,4-dihydro-1H-isoquinoline CAS Name: 6,7-dimethoxy-2-[3-(3-methoxy-4-nitrophenoxy)propyl]-3,4-dihydro-1H-isoquinoline IUPAC Name: 6,7-dimethoxy-2-[3-(3-methoxy-4-nitrophenoxy)propyl]-3,4-dihydro-1H-isoquinoline Traditional Name: 6,7-dimethoxy-2-[3-(3-methoxy-4-nitro-phenoxy)propyl]-3,4-dihydro-1H-isoquinoline Formula: C21H26N2O6 MolecularWeight: 402.44094

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2CN(CCC2=C1)CCCOC3=CC(=C(C=C3)[N+](=O)[O-])OC)OC

Isomeric SMILES

COC1=C(C=C2CN(CCC2=C1)CCCOC3=CC(=C(C=C3)[N+](=O)[O-])OC)OC

InChI

InChI=1S/C21H26N2O6/c1-26-19-13-17(5-6-18(19)23(24)25)29-10-4-8-22-9-7-15-11-20(27-2)21(28-3)12-16(15)14-22/h5-6,11-13H,4,7-10,14H2,1-3H3