2-pyridin-1-ium-1-ylethyl 2-cyanoethanoate

Systemtic Name: 2-pyridin-1-ium-1-ylethyl 2-cyanoethanoate Openeye Name: 2-pyridin-1-ium-1-ylethyl 2-cyanoacetate CAS Name: 2-cyanoacetic acid 2-(1-pyridin-1-iumyl)ethyl ester IUPAC Name: 2-pyridin-1-ium-1-ylethyl 2-cyanoacetate Traditional Name: 2-cyanoacetic acid 2-pyridin-1-ium-1-ylethyl ester Formula: C10H11N2O2+ MolecularWeight: 191.20654

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H11N2O2/c11-5-4-10(13)14-9-8-12-6-2-1-3-7-12/h1-3,6-7H,4,8-9H2/q+1