2-[(4-aminocarbonyl-2-nitro-phenyl)amino]butanoic acid

Systemtic Name: 2-[(4-aminocarbonyl-2-nitro-phenyl)amino]butanoic acid Openeye Name: 2-(4-carbamoyl-2-nitro-anilino)butanoic acid CAS Name: 2-(4-carbamoyl-2-nitroanilino)butanoic acid IUPAC Name: 2-(4-carbamoyl-2-nitroanilino)butanoic acid Traditional Name: 2-(4-carbamoyl-2-nitro-anilino)butyric acid Formula: C11H13N3O5 MolecularWeight: 267.23802

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)O)NC1=C(C=C(C=C1)C(=O)N)[N+](=O)[O-]

Isomeric SMILES

CCC(C(=O)O)NC1=C(C=C(C=C1)C(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C11H13N3O5/c1-2-7(11(16)17)13-8-4-3-6(10(12)15)5-9(8)14(18)19/h3-5,7,13H,2H2,1H3,(H2,12,15)(H,16,17)