2-chloranyl-1-[6,7-dimethoxy-1-(3-nitrophenyl)-3,4-dihydro-1H-isoquinolin-2-yl]ethanone

Systemtic Name: 2-chloranyl-1-[6,7-dimethoxy-1-(3-nitrophenyl)-3,4-dihydro-1H-isoquinolin-2-yl]ethanone Openeye Name: 2-chloro-1-[6,7-dimethoxy-1-(3-nitrophenyl)-3,4-dihydro-1H-isoquinolin-2-yl]ethanone CAS Name: 2-chloro-1-[6,7-dimethoxy-1-(3-nitrophenyl)-3,4-dihydro-1H-isoquinolin-2-yl]ethanone IUPAC Name: 2-chloro-1-[6,7-dimethoxy-1-(3-nitrophenyl)-3,4-dihydro-1H-isoquinolin-2-yl]ethanone Traditional Name: 2-chloro-1-[6,7-dimethoxy-1-(3-nitrophenyl)-3,4-dihydro-1H-isoquinolin-2-yl]ethanone Formula: C19H19ClN2O5 MolecularWeight: 390.81756

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(N(CCC2=C1)C(=O)CCl)C3=CC(=CC=C3)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C2C(N(CCC2=C1)C(=O)CCl)C3=CC(=CC=C3)[N+](=O)[O-])OC

InChI

InChI=1S/C19H19ClN2O5/c1-26-16-9-12-6-7-21(18(23)11-20)19(15(12)10-17(16)27-2)13-4-3-5-14(8-13)22(24)25/h3-5,8-10,19H,6-7,11H2,1-2H3