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

Systemtic Name: 2-[(2-aminocarbonyl-4-nitro-phenyl)amino]hexanoic acid Openeye Name: 2-(2-carbamoyl-4-nitro-anilino)hexanoic acid CAS Name: 2-(2-carbamoyl-4-nitroanilino)hexanoic acid IUPAC Name: 2-(2-carbamoyl-4-nitroanilino)hexanoic acid Traditional Name: 2-(2-carbamoyl-4-nitro-anilino)hexanoic acid Formula: C13H17N3O5 MolecularWeight: 295.29118

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H17N3O5/c1-2-3-4-11(13(18)19)15-10-6-5-8(16(20)21)7-9(10)12(14)17/h5-7,11,15H,2-4H2,1H3,(H2,14,17)(H,18,19)