1-[1-[(E)-3-(4-fluorophenyl)prop-2-enyl]piperidin-4-yl]-N-propan-2-yl-piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[1-[(E)-3-(4-fluorophenyl)prop-2-enyl]piperidin-4-yl]-N-propan-2-yl-piperidin-1-ium-4-carboxamide Openeye Name: 1-[1-[(E)-3-(4-fluorophenyl)allyl]-4-piperidyl]-N-isopropyl-piperidin-1-ium-4-carboxamide CAS Name: 1-[1-[(E)-3-(4-fluorophenyl)prop-2-enyl]-4-piperidinyl]-N-propan-2-yl-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[1-[(E)-3-(4-fluorophenyl)prop-2-enyl]piperidin-4-yl]-N-propan-2-ylpiperidin-1-ium-4-carboxamide Traditional Name: 1-[1-[(E)-3-(4-fluorophenyl)allyl]-4-piperidyl]-N-isopropyl-piperidin-1-ium-4-carboxamide Formula: C23H35FN3O+ MolecularWeight: 388.541903

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)C1CC[NH+](CC1)C2CCN(CC2)CC=CC3=CC=C(C=C3)F

Isomeric SMILES

CC(C)NC(=O)C1CC[NH+](CC1)C2CCN(CC2)C/C=C/C3=CC=C(C=C3)F

InChI

InChI=1S/C23H34FN3O/c1-18(2)25-23(28)20-9-16-27(17-10-20)22-11-14-26(15-12-22)13-3-4-19-5-7-21(24)8-6-19/h3-8,18,20,22H,9-17H2,1-2H3,(H,25,28)/p+1/b4-3+