3-[2-(4-nitrophenyl)ethanoylamino]butanoic acid

Systemtic Name: 3-[2-(4-nitrophenyl)ethanoylamino]butanoic acid Openeye Name: 3-[[2-(4-nitrophenyl)acetyl]amino]butanoic acid CAS Name: 3-[[2-(4-nitrophenyl)-1-oxoethyl]amino]butanoic acid IUPAC Name: 3-[[2-(4-nitrophenyl)acetyl]amino]butanoic acid Traditional Name: 3-[[2-(4-nitrophenyl)acetyl]amino]butyric acid Formula: C12H14N2O5 MolecularWeight: 266.24996

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)O)NC(=O)CC1=CC=C(C=C1)[N+](=O)[O-]

Isomeric SMILES

CC(CC(=O)O)NC(=O)CC1=CC=C(C=C1)[N+](=O)[O-]

InChI

InChI=1S/C12H14N2O5/c1-8(6-12(16)17)13-11(15)7-9-2-4-10(5-3-9)14(18)19/h2-5,8H,6-7H2,1H3,(H,13,15)(H,16,17)