3-(4-iodophenyl)-2-[(4-nitrophenyl)carbamoylamino]propanoic acid

Systemtic Name: 3-(4-iodophenyl)-2-[(4-nitrophenyl)carbamoylamino]propanoic acid Openeye Name: 3-(4-iodophenyl)-2-[(4-nitrophenyl)carbamoylamino]propanoic acid CAS Name: 3-(4-iodophenyl)-2-[[(4-nitroanilino)-oxomethyl]amino]propanoic acid IUPAC Name: 3-(4-iodophenyl)-2-[(4-nitrophenyl)carbamoylamino]propanoic acid Traditional Name: 3-(4-iodophenyl)-2-[(4-nitrophenyl)carbamoylamino]propionic acid Formula: C16H14IN3O5 MolecularWeight: 455.20393

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC(C(=O)O)NC(=O)NC2=CC=C(C=C2)[N+](=O)[O-])I

Isomeric SMILES

C1=CC(=CC=C1CC(C(=O)O)NC(=O)NC2=CC=C(C=C2)[N+](=O)[O-])I

InChI

InChI=1S/C16H14IN3O5/c17-11-3-1-10(2-4-11)9-14(15(21)22)19-16(23)18-12-5-7-13(8-6-12)20(24)25/h1-8,14H,9H2,(H,21,22)(H2,18,19,23)