3-(4-ethoxy-3-methoxy-phenyl)-3-[(3-nitrophenyl)carbonylamino]propanoic acid

Systemtic Name: 3-(4-ethoxy-3-methoxy-phenyl)-3-[(3-nitrophenyl)carbonylamino]propanoic acid Openeye Name: 3-(4-ethoxy-3-methoxy-phenyl)-3-[(3-nitrobenzoyl)amino]propanoic acid CAS Name: 3-(4-ethoxy-3-methoxyphenyl)-3-[[(3-nitrophenyl)-oxomethyl]amino]propanoic acid IUPAC Name: 3-(4-ethoxy-3-methoxyphenyl)-3-[(3-nitrobenzoyl)amino]propanoic acid Traditional Name: 3-(4-ethoxy-3-methoxy-phenyl)-3-[(3-nitrobenzoyl)amino]propionic acid Formula: C19H20N2O7 MolecularWeight: 388.3713

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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