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4-[(2-acetamido-3-ethoxy-3-oxidanylidene-propanoyl)oxymethyl]-N-ethanoyl-benzonitrilium

4-[(2-acetamido-3-ethoxy-3-oxidanylidene-propanoyl)oxymethyl]-N-ethanoyl-benzonitrilium

Systemtic Name:4-[(2-acetamido-3-ethoxy-3-oxidanylidene-propanoyl)oxymethyl]-N-ethanoyl-benzonitrilium
Openeye Name:4-[(2-acetamido-3-ethoxy-3-oxo-propanoyl)oxymethyl]-N-acetyl-benzonitrilium
CAS Name:4-[(2-acetamido-3-ethoxy-1,3-dioxopropoxy)methyl]-N-acetylbenzonitrilium
IUPAC Name:4-[(2-acetamido-3-ethoxy-3-oxopropanoyl)oxymethyl]-N-acetylbenzonitrilium
Traditional Name:4-[(2-acetamido-3-ethoxy-3-keto-propanoyl)oxymethyl]-N-acetyl-benzonitrilium
Formula: C17H19N2O6+
MolecularWeight: 347.34256
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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(=O)OCC1=CC=C(C=C1)C#[N+]C(=O)C)NC(=O)C


Isomeric SMILES

CCOC(=O)C(C(=O)OCC1=CC=C(C=C1)C#[N+]C(=O)C)NC(=O)C


InChI

InChI=1S/C17H18N2O6/c1-4-24-16(22)15(19-12(3)21)17(23)25-10-14-7-5-13(6-8-14)9-18-11(2)20/h5-8,15H,4,10H2,1-3H3/p+1


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