3-(2-chloranyl-5-nitro-phenyl)-3-[(3-methoxyphenyl)carbonylamino]propanoic acid

Systemtic Name: 3-(2-chloranyl-5-nitro-phenyl)-3-[(3-methoxyphenyl)carbonylamino]propanoic acid Openeye Name: 3-(2-chloro-5-nitro-phenyl)-3-[(3-methoxybenzoyl)amino]propanoic acid CAS Name: 3-(2-chloro-5-nitrophenyl)-3-[[(3-methoxyphenyl)-oxomethyl]amino]propanoic acid IUPAC Name: 3-(2-chloro-5-nitrophenyl)-3-[(3-methoxybenzoyl)amino]propanoic acid Traditional Name: 3-(2-chloro-5-nitro-phenyl)-3-(m-anisoylamino)propionic acid Formula: C17H15ClN2O6 MolecularWeight: 378.7638

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(=O)NC(CC(=O)O)C2=C(C=CC(=C2)[N+](=O)[O-])Cl

Isomeric SMILES

COC1=CC=CC(=C1)C(=O)NC(CC(=O)O)C2=C(C=CC(=C2)[N+](=O)[O-])Cl

InChI

InChI=1S/C17H15ClN2O6/c1-26-12-4-2-3-10(7-12)17(23)19-15(9-16(21)22)13-8-11(20(24)25)5-6-14(13)18/h2-8,15H,9H2,1H3,(H,19,23)(H,21,22)