methyl 3-(3,4-dimethoxyphenyl)-3-[(4-ethoxy-5-methoxy-2-nitro-phenyl)carbonylamino]propanoate

Systemtic Name: methyl 3-(3,4-dimethoxyphenyl)-3-[(4-ethoxy-5-methoxy-2-nitro-phenyl)carbonylamino]propanoate Openeye Name: methyl 3-(3,4-dimethoxyphenyl)-3-[(4-ethoxy-5-methoxy-2-nitro-benzoyl)amino]propanoate CAS Name: 3-(3,4-dimethoxyphenyl)-3-[[(4-ethoxy-5-methoxy-2-nitrophenyl)-oxomethyl]amino]propanoic acid methyl ester IUPAC Name: methyl 3-(3,4-dimethoxyphenyl)-3-[(4-ethoxy-5-methoxy-2-nitrobenzoyl)amino]propanoate Traditional Name: 3-(3,4-dimethoxyphenyl)-3-[(4-ethoxy-5-methoxy-2-nitro-benzoyl)amino]propionic acid methyl ester Formula: C22H26N2O9 MolecularWeight: 462.44984

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C(=C1)[N+](=O)[O-])C(=O)NC(CC(=O)OC)C2=CC(=C(C=C2)OC)OC)OC

Isomeric SMILES

CCOC1=C(C=C(C(=C1)[N+](=O)[O-])C(=O)NC(CC(=O)OC)C2=CC(=C(C=C2)OC)OC)OC

InChI

InChI=1S/C22H26N2O9/c1-6-33-20-12-16(24(27)28)14(10-19(20)31-4)22(26)23-15(11-21(25)32-5)13-7-8-17(29-2)18(9-13)30-3/h7-10,12,15H,6,11H2,1-5H3,(H,23,26)