1-[(E)-3-phenylprop-2-enyl]-N-[3-(1H-pyrazol-5-yl)phenyl]piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[(E)-3-phenylprop-2-enyl]-N-[3-(1H-pyrazol-5-yl)phenyl]piperidin-1-ium-4-carboxamide Openeye Name: 1-[(E)-cinnamyl]-N-[3-(1H-pyrazol-5-yl)phenyl]piperidin-1-ium-4-carboxamide CAS Name: 1-[(E)-3-phenylprop-2-enyl]-N-[3-(1H-pyrazol-5-yl)phenyl]-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[(E)-3-phenylprop-2-enyl]-N-[3-(1H-pyrazol-5-yl)phenyl]piperidin-1-ium-4-carboxamide Traditional Name: 1-[(E)-cinnamyl]-N-[3-(1H-pyrazol-5-yl)phenyl]piperidin-1-ium-4-carboxamide Formula: C24H27N4O+ MolecularWeight: 387.49738

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1C(=O)NC2=CC=CC(=C2)C3=CC=NN3)CC=CC4=CC=CC=C4

Isomeric SMILES

C1C[NH+](CCC1C(=O)NC2=CC=CC(=C2)C3=CC=NN3)C/C=C/C4=CC=CC=C4

InChI

InChI=1S/C24H26N4O/c29-24(26-22-10-4-9-21(18-22)23-11-14-25-27-23)20-12-16-28(17-13-20)15-5-8-19-6-2-1-3-7-19/h1-11,14,18,20H,12-13,15-17H2,(H,25,27)(H,26,29)/p+1/b8-5+