4-[[2-[(4-nitrophenyl)amino]-2-oxidanylidene-ethyl]amino]butanoic acid

Systemtic Name: 4-[[2-[(4-nitrophenyl)amino]-2-oxidanylidene-ethyl]amino]butanoic acid Openeye Name: 4-[[2-(4-nitroanilino)-2-oxo-ethyl]amino]butanoic acid CAS Name: 4-[[2-(4-nitroanilino)-2-oxoethyl]amino]butanoic acid IUPAC Name: 4-[[2-(4-nitroanilino)-2-oxoethyl]amino]butanoic acid Traditional Name: 4-[[2-keto-2-(4-nitroanilino)ethyl]amino]butyric acid Formula: C12H15N3O5 MolecularWeight: 281.2646

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC(=O)CNCCCC(=O)O)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1NC(=O)CNCCCC(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C12H15N3O5/c16-11(8-13-7-1-2-12(17)18)14-9-3-5-10(6-4-9)15(19)20/h3-6,13H,1-2,7-8H2,(H,14,16)(H,17,18)