methyl 2-benzamido-3-nitrooxy-butanoate

Systemtic Name: methyl 2-benzamido-3-nitrooxy-butanoate Openeye Name: methyl 2-benzamido-3-nitrooxy-butanoate CAS Name: 2-benzamido-3-nitrooxybutanoic acid methyl ester IUPAC Name: methyl 2-benzamido-3-nitrooxybutanoate Traditional Name: 2-benzamido-3-nitrooxy-butyric acid methyl ester Formula: C12H14N2O6 MolecularWeight: 282.24936

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H14N2O6/c1-8(20-14(17)18)10(12(16)19-2)13-11(15)9-6-4-3-5-7-9/h3-8,10H,1-2H3,(H,13,15)