3-[(4-aminocarbonyl-2-nitro-phenyl)amino]butanoic acid

Systemtic Name: 3-[(4-aminocarbonyl-2-nitro-phenyl)amino]butanoic acid Openeye Name: 3-(4-carbamoyl-2-nitro-anilino)butanoic acid CAS Name: 3-(4-carbamoyl-2-nitroanilino)butanoic acid IUPAC Name: 3-(4-carbamoyl-2-nitroanilino)butanoic acid Traditional Name: 3-(4-carbamoyl-2-nitro-anilino)butyric acid Formula: C11H13N3O5 MolecularWeight: 267.23802

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H13N3O5/c1-6(4-10(15)16)13-8-3-2-7(11(12)17)5-9(8)14(18)19/h2-3,5-6,13H,4H2,1H3,(H2,12,17)(H,15,16)