3-[(2,4-dinitrophenyl)amino]-3-phenyl-propanoic acid

Systemtic Name: 3-[(2,4-dinitrophenyl)amino]-3-phenyl-propanoic acid Openeye Name: 3-(2,4-dinitroanilino)-3-phenyl-propanoic acid CAS Name: 3-(2,4-dinitroanilino)-3-phenylpropanoic acid IUPAC Name: 3-(2,4-dinitroanilino)-3-phenylpropanoic acid Traditional Name: 3-(2,4-dinitroanilino)-3-phenyl-propionic acid Formula: C15H13N3O6 MolecularWeight: 331.28022

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H13N3O6/c19-15(20)9-13(10-4-2-1-3-5-10)16-12-7-6-11(17(21)22)8-14(12)18(23)24/h1-8,13,16H,9H2,(H,19,20)