1-[(Z)-2-chloranyl-3-phenyl-prop-2-enyl]-N-[3-(1H-pyrazol-5-yl)phenyl]piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[(Z)-2-chloranyl-3-phenyl-prop-2-enyl]-N-[3-(1H-pyrazol-5-yl)phenyl]piperidin-1-ium-4-carboxamide Openeye Name: 1-[(Z)-2-chloro-3-phenyl-allyl]-N-[3-(1H-pyrazol-5-yl)phenyl]piperidin-1-ium-4-carboxamide CAS Name: 1-[(Z)-2-chloro-3-phenylprop-2-enyl]-N-[3-(1H-pyrazol-5-yl)phenyl]-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[(Z)-2-chloro-3-phenylprop-2-enyl]-N-[3-(1H-pyrazol-5-yl)phenyl]piperidin-1-ium-4-carboxamide Traditional Name: 1-[(Z)-2-chloro-3-phenyl-allyl]-N-[3-(1H-pyrazol-5-yl)phenyl]piperidin-1-ium-4-carboxamide Formula: C24H26ClN4O+ MolecularWeight: 421.94244

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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)Cl

Isomeric SMILES

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

InChI

InChI=1S/C24H25ClN4O/c25-21(15-18-5-2-1-3-6-18)17-29-13-10-19(11-14-29)24(30)27-22-8-4-7-20(16-22)23-9-12-26-28-23/h1-9,12,15-16,19H,10-11,13-14,17H2,(H,26,28)(H,27,30)/p+1/b21-15-