ethyl 1-[(E)-3-phenylprop-2-enyl]piperidin-1-ium-4-carboxylate

Systemtic Name: ethyl 1-[(E)-3-phenylprop-2-enyl]piperidin-1-ium-4-carboxylate Openeye Name: ethyl 1-[(E)-cinnamyl]piperidin-1-ium-4-carboxylate CAS Name: 1-[(E)-3-phenylprop-2-enyl]-4-piperidin-1-iumcarboxylic acid ethyl ester IUPAC Name: ethyl 1-[(E)-3-phenylprop-2-enyl]piperidin-1-ium-4-carboxylate Traditional Name: 1-[(E)-cinnamyl]piperidin-1-ium-4-carboxylic acid ethyl ester Formula: C17H24NO2+ MolecularWeight: 274.37796

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CC[NH+](CC1)CC=CC2=CC=CC=C2

Isomeric SMILES

CCOC(=O)C1CC[NH+](CC1)C/C=C/C2=CC=CC=C2

InChI

InChI=1S/C17H23NO2/c1-2-20-17(19)16-10-13-18(14-11-16)12-6-9-15-7-4-3-5-8-15/h3-9,16H,2,10-14H2,1H3/p+1/b9-6+