phenyl 4-(dimethylamino)pyridin-1-ium-1-carboxylate

Systemtic Name: phenyl 4-(dimethylamino)pyridin-1-ium-1-carboxylate Openeye Name: phenyl 4-(dimethylamino)pyridin-1-ium-1-carboxylate CAS Name: 4-(dimethylamino)-1-pyridin-1-iumcarboxylic acid phenyl ester IUPAC Name: phenyl 4-(dimethylamino)pyridin-1-ium-1-carboxylate Traditional Name: 4-(dimethylamino)pyridin-1-ium-1-carboxylic acid phenyl ester Formula: C14H15N2O2+ MolecularWeight: 243.2811

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=[N+](C=C1)C(=O)OC2=CC=CC=C2

Isomeric SMILES

CN(C)C1=CC=[N+](C=C1)C(=O)OC2=CC=CC=C2

InChI

InChI=1S/C14H15N2O2/c1-15(2)12-8-10-16(11-9-12)14(17)18-13-6-4-3-5-7-13/h3-11H,1-2H3/q+1