2-[4-[(5-nitropyridin-2-yl)amino]phenyl]propanoic acid

Systemtic Name: 2-[4-[(5-nitropyridin-2-yl)amino]phenyl]propanoic acid Openeye Name: 2-[4-[(5-nitro-2-pyridyl)amino]phenyl]propanoic acid CAS Name: 2-[4-[(5-nitro-2-pyridinyl)amino]phenyl]propanoic acid IUPAC Name: 2-[4-[(5-nitropyridin-2-yl)amino]phenyl]propanoic acid Traditional Name: 2-[4-[(5-nitro-2-pyridyl)amino]phenyl]propionic acid Formula: C14H13N3O4 MolecularWeight: 287.27072

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H13N3O4/c1-9(14(18)19)10-2-4-11(5-3-10)16-13-7-6-12(8-15-13)17(20)21/h2-9H,1H3,(H,15,16)(H,18,19)