3-(3-azanyl-5-nitro-phenyl)propanoic acid

Systemtic Name: 3-(3-azanyl-5-nitro-phenyl)propanoic acid Openeye Name: 3-(3-amino-5-nitro-phenyl)propanoic acid CAS Name: 3-(3-amino-5-nitrophenyl)propanoic acid IUPAC Name: 3-(3-amino-5-nitrophenyl)propanoic acid Traditional Name: 3-(3-amino-5-nitro-phenyl)propionic acid Formula: C9H10N2O4 MolecularWeight: 210.1867

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C=C1N)[N+](=O)[O-])CCC(=O)O

Isomeric SMILES

C1=C(C=C(C=C1N)[N+](=O)[O-])CCC(=O)O

InChI

InChI=1S/C9H10N2O4/c10-7-3-6(1-2-9(12)13)4-8(5-7)11(14)15/h3-5H,1-2,10H2,(H,12,13)