4-[2-(4-nitrophenyl)ethylamino]butanoic acid

Systemtic Name: 4-[2-(4-nitrophenyl)ethylamino]butanoic acid Openeye Name: 4-[2-(4-nitrophenyl)ethylamino]butanoic acid CAS Name: 4-[2-(4-nitrophenyl)ethylamino]butanoic acid IUPAC Name: 4-[2-(4-nitrophenyl)ethylamino]butanoic acid Traditional Name: 4-[2-(4-nitrophenyl)ethylamino]butyric acid Formula: C12H16N2O4 MolecularWeight: 252.26644

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CCNCCCC(=O)O)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1CCNCCCC(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C12H16N2O4/c15-12(16)2-1-8-13-9-7-10-3-5-11(6-4-10)14(17)18/h3-6,13H,1-2,7-9H2,(H,15,16)