7-[(3-nitrophenyl)amino]heptanoic acid

Systemtic Name: 7-[(3-nitrophenyl)amino]heptanoic acid Openeye Name: 7-(3-nitroanilino)heptanoic acid CAS Name: 7-(3-nitroanilino)heptanoic acid IUPAC Name: 7-(3-nitroanilino)heptanoic acid Traditional Name: 7-(3-nitroanilino)enanthic acid Formula: C13H18N2O4 MolecularWeight: 266.29302

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])NCCCCCCC(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])NCCCCCCC(=O)O

InChI

InChI=1S/C13H18N2O4/c16-13(17)8-3-1-2-4-9-14-11-6-5-7-12(10-11)15(18)19/h5-7,10,14H,1-4,8-9H2,(H,16,17)