2-azanyl-2-[(3-nitrophenyl)methyl]-3-oxidanylidene-butanoic acid

Systemtic Name: 2-azanyl-2-[(3-nitrophenyl)methyl]-3-oxidanylidene-butanoic acid Openeye Name: 2-amino-2-[(3-nitrophenyl)methyl]-3-oxo-butanoic acid CAS Name: 2-amino-2-[(3-nitrophenyl)methyl]-3-oxobutanoic acid IUPAC Name: 2-amino-2-[(3-nitrophenyl)methyl]-3-oxobutanoic acid Traditional Name: 2-amino-3-keto-2-(3-nitrobenzyl)butyric acid Formula: C11H12N2O5 MolecularWeight: 252.22338

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H12N2O5/c1-7(14)11(12,10(15)16)6-8-3-2-4-9(5-8)13(17)18/h2-5H,6,12H2,1H3,(H,15,16)