6-[(2-chloranyl-6-nitro-phenyl)amino]hexanoate

Systemtic Name: 6-[(2-chloranyl-6-nitro-phenyl)amino]hexanoate Openeye Name: 6-(2-chloro-6-nitro-anilino)hexanoate CAS Name: 6-(2-chloro-6-nitroanilino)hexanoate IUPAC Name: 6-(2-chloro-6-nitroanilino)hexanoate Traditional Name: 6-(2-chloro-6-nitro-anilino)hexanoate Formula: C12H14ClN2O4- MolecularWeight: 285.70356

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H15ClN2O4/c13-9-5-4-6-10(15(18)19)12(9)14-8-3-1-2-7-11(16)17/h4-6,14H,1-3,7-8H2,(H,16,17)/p-1