1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-3-(4-nitrophenyl)propan-1-one

Systemtic Name: 1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-3-(4-nitrophenyl)propan-1-one Openeye Name: 1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-3-(4-nitrophenyl)propan-1-one CAS Name: 1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-3-(4-nitrophenyl)-1-propanone IUPAC Name: 1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-3-(4-nitrophenyl)propan-1-one Traditional Name: 1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-3-(4-nitrophenyl)propan-1-one Formula: C20H22N2O5 MolecularWeight: 370.39908

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2CN(CCC2=C1)C(=O)CCC3=CC=C(C=C3)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C2CN(CCC2=C1)C(=O)CCC3=CC=C(C=C3)[N+](=O)[O-])OC

InChI

InChI=1S/C20H22N2O5/c1-26-18-11-15-9-10-21(13-16(15)12-19(18)27-2)20(23)8-5-14-3-6-17(7-4-14)22(24)25/h3-4,6-7,11-12H,5,8-10,13H2,1-2H3