(4-aminocarbonyl-2-nitro-phenyl)methyl 3-(3,4-dimethoxyphenyl)propanoate

Systemtic Name: (4-aminocarbonyl-2-nitro-phenyl)methyl 3-(3,4-dimethoxyphenyl)propanoate Openeye Name: (4-carbamoyl-2-nitro-phenyl)methyl 3-(3,4-dimethoxyphenyl)propanoate CAS Name: 3-(3,4-dimethoxyphenyl)propanoic acid (4-carbamoyl-2-nitrophenyl)methyl ester IUPAC Name: (4-carbamoyl-2-nitrophenyl)methyl 3-(3,4-dimethoxyphenyl)propanoate Traditional Name: 3-(3,4-dimethoxyphenyl)propionic acid (4-carbamoyl-2-nitro-benzyl) ester Formula: C19H20N2O7 MolecularWeight: 388.3713

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCC(=O)OCC2=C(C=C(C=C2)C(=O)N)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCC(=O)OCC2=C(C=C(C=C2)C(=O)N)[N+](=O)[O-])OC

InChI

InChI=1S/C19H20N2O7/c1-26-16-7-3-12(9-17(16)27-2)4-8-18(22)28-11-14-6-5-13(19(20)23)10-15(14)21(24)25/h3,5-7,9-10H,4,8,11H2,1-2H3,(H2,20,23)