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

Systemtic Name: 2-azanyl-3-[2-(2,4-dinitrophenyl)-4-oxidanyl-phenyl]propanoic acid Openeye Name: 2-amino-3-[2-(2,4-dinitrophenyl)-4-hydroxy-phenyl]propanoic acid CAS Name: 2-amino-3-[2-(2,4-dinitrophenyl)-4-hydroxyphenyl]propanoic acid IUPAC Name: 2-amino-3-[2-(2,4-dinitrophenyl)-4-hydroxyphenyl]propanoic acid Traditional Name: 2-amino-3-[2-(2,4-dinitrophenyl)-4-hydroxy-phenyl]propionic acid Formula: C15H13N3O7 MolecularWeight: 347.27962

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H13N3O7/c16-13(15(20)21)5-8-1-3-10(19)7-12(8)11-4-2-9(17(22)23)6-14(11)18(24)25/h1-4,6-7,13,19H,5,16H2,(H,20,21)