ethyl 3-(4-methyl-7-nitro-3,4-dihydro-1H-isoquinolin-2-yl)propanoate

Systemtic Name: ethyl 3-(4-methyl-7-nitro-3,4-dihydro-1H-isoquinolin-2-yl)propanoate Openeye Name: ethyl 3-(4-methyl-7-nitro-3,4-dihydro-1H-isoquinolin-2-yl)propanoate CAS Name: 3-(4-methyl-7-nitro-3,4-dihydro-1H-isoquinolin-2-yl)propanoic acid ethyl ester IUPAC Name: ethyl 3-(4-methyl-7-nitro-3,4-dihydro-1H-isoquinolin-2-yl)propanoate Traditional Name: 3-(4-methyl-7-nitro-3,4-dihydro-1H-isoquinolin-2-yl)propionic acid ethyl ester Formula: C15H20N2O4 MolecularWeight: 292.3303

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCN1CC(C2=C(C1)C=C(C=C2)[N+](=O)[O-])C

Isomeric SMILES

CCOC(=O)CCN1CC(C2=C(C1)C=C(C=C2)[N+](=O)[O-])C

InChI

InChI=1S/C15H20N2O4/c1-3-21-15(18)6-7-16-9-11(2)14-5-4-13(17(19)20)8-12(14)10-16/h4-5,8,11H,3,6-7,9-10H2,1-2H3