3-[(3-nitrophenyl)amino]-3-oxidanylidene-propanoic acid

Systemtic Name: 3-[(3-nitrophenyl)amino]-3-oxidanylidene-propanoic acid Openeye Name: 3-(3-nitroanilino)-3-oxo-propanoic acid CAS Name: 3-(3-nitroanilino)-3-oxopropanoic acid IUPAC Name: 3-(3-nitroanilino)-3-oxopropanoic acid Traditional Name: 3-keto-3-(3-nitroanilino)propionic acid Formula: C9H8N2O5 MolecularWeight: 224.17022

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H8N2O5/c12-8(5-9(13)14)10-6-2-1-3-7(4-6)11(15)16/h1-4H,5H2,(H,10,12)(H,13,14)