nonyl 1-ethyl-4-phenyl-pyridin-1-ium-3-carboxylate

Systemtic Name: nonyl 1-ethyl-4-phenyl-pyridin-1-ium-3-carboxylate Openeye Name: nonyl 1-ethyl-4-phenyl-pyridin-1-ium-3-carboxylate CAS Name: 1-ethyl-4-phenyl-3-pyridin-1-iumcarboxylic acid nonyl ester IUPAC Name: nonyl 1-ethyl-4-phenylpyridin-1-ium-3-carboxylate Traditional Name: 1-ethyl-4-phenyl-pyridin-1-ium-3-carboxylic acid nonyl ester Formula: C23H32NO2+ MolecularWeight: 354.50568

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H32NO2/c1-3-5-6-7-8-9-13-18-26-23(25)22-19-24(4-2)17-16-21(22)20-14-11-10-12-15-20/h10-12,14-17,19H,3-9,13,18H2,1-2H3/q+1