3-(5-ethoxycarbonylpyridin-3-yl)prop-2-ynyl-dimethyl-azanium

Systemtic Name: 3-(5-ethoxycarbonylpyridin-3-yl)prop-2-ynyl-dimethyl-azanium Openeye Name: 3-(5-ethoxycarbonyl-3-pyridyl)prop-2-ynyl-dimethyl-ammonium CAS Name: 3-(5-ethoxycarbonyl-3-pyridinyl)prop-2-ynyl-dimethylammonium IUPAC Name: 3-(5-ethoxycarbonylpyridin-3-yl)prop-2-ynyl-dimethylazanium Traditional Name: 3-(5-carbethoxy-3-pyridyl)prop-2-ynyl-dimethyl-ammonium Formula: C13H17N2O2+ MolecularWeight: 233.28628

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=CC(=C1)C#CC[NH+](C)C

Isomeric SMILES

CCOC(=O)C1=CN=CC(=C1)C#CC[NH+](C)C

InChI

InChI=1S/C13H16N2O2/c1-4-17-13(16)12-8-11(9-14-10-12)6-5-7-15(2)3/h8-10H,4,7H2,1-3H3/p+1