(4-aminocarbonyl-2-nitro-phenyl)methyl 3-(3,5-dimethoxyphenyl)propanoate

Systemtic Name: (4-aminocarbonyl-2-nitro-phenyl)methyl 3-(3,5-dimethoxyphenyl)propanoate Openeye Name: (4-carbamoyl-2-nitro-phenyl)methyl 3-(3,5-dimethoxyphenyl)propanoate CAS Name: 3-(3,5-dimethoxyphenyl)propanoic acid (4-carbamoyl-2-nitrophenyl)methyl ester IUPAC Name: (4-carbamoyl-2-nitrophenyl)methyl 3-(3,5-dimethoxyphenyl)propanoate Traditional Name: 3-(3,5-dimethoxyphenyl)propionic acid (4-carbamoyl-2-nitro-benzyl) ester Formula: C19H20N2O7 MolecularWeight: 388.3713

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H20N2O7/c1-26-15-7-12(8-16(10-15)27-2)3-6-18(22)28-11-14-5-4-13(19(20)23)9-17(14)21(24)25/h4-5,7-10H,3,6,11H2,1-2H3,(H2,20,23)