4-[(3-nitrophenyl)carbonylamino]butanoic acid

Systemtic Name: 4-[(3-nitrophenyl)carbonylamino]butanoic acid Openeye Name: 4-[(3-nitrobenzoyl)amino]butanoic acid CAS Name: 4-[[(3-nitrophenyl)-oxomethyl]amino]butanoic acid IUPAC Name: 4-[(3-nitrobenzoyl)amino]butanoic acid Traditional Name: 4-[(3-nitrobenzoyl)amino]butyric acid Formula: C11H12N2O5 MolecularWeight: 252.22338

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H12N2O5/c14-10(15)5-2-6-12-11(16)8-3-1-4-9(7-8)13(17)18/h1,3-4,7H,2,5-6H2,(H,12,16)(H,14,15)