(3S)-N,N-diethyl-1-[(E)-3-phenylprop-2-enyl]piperidin-1-ium-3-carboxamide

Systemtic Name: (3S)-N,N-diethyl-1-[(E)-3-phenylprop-2-enyl]piperidin-1-ium-3-carboxamide Openeye Name: (3S)-1-[(E)-cinnamyl]-N,N-diethyl-piperidin-1-ium-3-carboxamide CAS Name: (3S)-N,N-diethyl-1-[(E)-3-phenylprop-2-enyl]-3-piperidin-1-iumcarboxamide IUPAC Name: (3S)-N,N-diethyl-1-[(E)-3-phenylprop-2-enyl]piperidin-1-ium-3-carboxamide Traditional Name: (3S)-1-[(E)-cinnamyl]-N,N-diethyl-piperidin-1-ium-3-carboxamide Formula: C19H29N2O+ MolecularWeight: 301.44636

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1CCC[NH+](C1)CC=CC2=CC=CC=C2

Isomeric SMILES

CCN(CC)C(=O)[C@H]1CCC[NH+](C1)C/C=C/C2=CC=CC=C2

InChI

InChI=1S/C19H28N2O/c1-3-21(4-2)19(22)18-13-9-15-20(16-18)14-8-12-17-10-6-5-7-11-17/h5-8,10-12,18H,3-4,9,13-16H2,1-2H3/p+1/b12-8+/t18-/m0/s1