6,7-dimethoxy-2-[4-(4-nitrophenoxy)butyl]-3,4-dihydro-1H-isoquinoline

Systemtic Name: 6,7-dimethoxy-2-[4-(4-nitrophenoxy)butyl]-3,4-dihydro-1H-isoquinoline Openeye Name: 6,7-dimethoxy-2-[4-(4-nitrophenoxy)butyl]-3,4-dihydro-1H-isoquinoline CAS Name: 6,7-dimethoxy-2-[4-(4-nitrophenoxy)butyl]-3,4-dihydro-1H-isoquinoline IUPAC Name: 6,7-dimethoxy-2-[4-(4-nitrophenoxy)butyl]-3,4-dihydro-1H-isoquinoline Traditional Name: 6,7-dimethoxy-2-[4-(4-nitrophenoxy)butyl]-3,4-dihydro-1H-isoquinoline Formula: C21H26N2O5 MolecularWeight: 386.44154

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2CN(CCC2=C1)CCCCOC3=CC=C(C=C3)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C2CN(CCC2=C1)CCCCOC3=CC=C(C=C3)[N+](=O)[O-])OC

InChI

InChI=1S/C21H26N2O5/c1-26-20-13-16-9-11-22(15-17(16)14-21(20)27-2)10-3-4-12-28-19-7-5-18(6-8-19)23(24)25/h5-8,13-14H,3-4,9-12,15H2,1-2H3