4-[(2-aminocarbonyl-4-nitro-phenyl)amino]butanoate

Systemtic Name: 4-[(2-aminocarbonyl-4-nitro-phenyl)amino]butanoate Openeye Name: 4-(2-carbamoyl-4-nitro-anilino)butanoate CAS Name: 4-(2-carbamoyl-4-nitroanilino)butanoate IUPAC Name: 4-(2-carbamoyl-4-nitroanilino)butanoate Traditional Name: 4-(2-carbamoyl-4-nitro-anilino)butyrate Formula: C11H12N3O5- MolecularWeight: 266.23008

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H13N3O5/c12-11(17)8-6-7(14(18)19)3-4-9(8)13-5-1-2-10(15)16/h3-4,6,13H,1-2,5H2,(H2,12,17)(H,15,16)/p-1