2-[(3-nitrophenyl)methylamino]ethanoic acid

Systemtic Name: 2-[(3-nitrophenyl)methylamino]ethanoic acid Openeye Name: 2-[(3-nitrophenyl)methylamino]acetic acid CAS Name: 2-[(3-nitrophenyl)methylamino]acetic acid IUPAC Name: 2-[(3-nitrophenyl)methylamino]acetic acid Traditional Name: 2-[(3-nitrobenzyl)amino]acetic acid Formula: C9H10N2O4 MolecularWeight: 210.1867

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])CNCC(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])CNCC(=O)O

InChI

InChI=1S/C9H10N2O4/c12-9(13)6-10-5-7-2-1-3-8(4-7)11(14)15/h1-4,10H,5-6H2,(H,12,13)