2-[(2,3-dinitrophenyl)methyl-phenyl-amino]ethanoic acid

Systemtic Name: 2-[(2,3-dinitrophenyl)methyl-phenyl-amino]ethanoic acid Openeye Name: 2-[N-[(2,3-dinitrophenyl)methyl]anilino]acetic acid CAS Name: 2-[N-[(2,3-dinitrophenyl)methyl]anilino]acetic acid IUPAC Name: 2-[N-[(2,3-dinitrophenyl)methyl]anilino]acetic acid Traditional Name: 2-(N-(2,3-dinitrobenzyl)anilino)acetic acid Formula: C15H13N3O6 MolecularWeight: 331.28022

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N(CC2=C(C(=CC=C2)[N+](=O)[O-])[N+](=O)[O-])CC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)N(CC2=C(C(=CC=C2)[N+](=O)[O-])[N+](=O)[O-])CC(=O)O

InChI

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