sodium 3-(4-chlorophenyl)-2-[2-(4-nitrophenyl)ethanoylamino]propanoate

Systemtic Name: sodium 3-(4-chlorophenyl)-2-[2-(4-nitrophenyl)ethanoylamino]propanoate Openeye Name: sodium 3-(4-chlorophenyl)-2-[[2-(4-nitrophenyl)acetyl]amino]propanoate CAS Name: sodium 3-(4-chlorophenyl)-2-[[2-(4-nitrophenyl)-1-oxoethyl]amino]propanoate IUPAC Name: sodium 3-(4-chlorophenyl)-2-[[2-(4-nitrophenyl)acetyl]amino]propanoate Traditional Name: sodium 3-(4-chlorophenyl)-2-[[2-(4-nitrophenyl)acetyl]amino]propionate Formula: C17H14ClN2NaO5 MolecularWeight: 384.74623

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC(C(=O)[O-])NC(=O)CC2=CC=C(C=C2)[N+](=O)[O-])Cl.[Na+]

Isomeric SMILES

C1=CC(=CC=C1CC(C(=O)[O-])NC(=O)CC2=CC=C(C=C2)[N+](=O)[O-])Cl.[Na+]

InChI

InChI=1S/C17H15ClN2O5.Na/c18-13-5-1-11(2-6-13)9-15(17(22)23)19-16(21)10-12-3-7-14(8-4-12)20(24)25;/h1-8,15H,9-10H2,(H,19,21)(H,22,23);/q;+1/p-1