1-(4-fluorophenyl)-4-[(3S)-1-[(E)-2-methylbut-2-enyl]piperidin-1-ium-3-yl]piperazine

Systemtic Name: 1-(4-fluorophenyl)-4-[(3S)-1-[(E)-2-methylbut-2-enyl]piperidin-1-ium-3-yl]piperazine Openeye Name: 1-(4-fluorophenyl)-4-[(3S)-1-[(E)-2-methylbut-2-enyl]piperidin-1-ium-3-yl]piperazine CAS Name: 1-(4-fluorophenyl)-4-[(3S)-1-[(E)-2-methylbut-2-enyl]-3-piperidin-1-iumyl]piperazine IUPAC Name: 1-(4-fluorophenyl)-4-[(3S)-1-[(E)-2-methylbut-2-enyl]piperidin-1-ium-3-yl]piperazine Traditional Name: 1-(4-fluorophenyl)-4-[(3S)-1-[(E)-2-methylbut-2-enyl]piperidin-1-ium-3-yl]piperazine Formula: C20H31FN3+ MolecularWeight: 332.478643

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Descriptors Computed from Structure

Canonical SMILES:

CC=C(C)C[NH+]1CCCC(C1)N2CCN(CC2)C3=CC=C(C=C3)F

Isomeric SMILES

C/C=C(\C)/C[NH+]1CCC[C@@H](C1)N2CCN(CC2)C3=CC=C(C=C3)F

InChI

InChI=1S/C20H30FN3/c1-3-17(2)15-22-10-4-5-20(16-22)24-13-11-23(12-14-24)19-8-6-18(21)7-9-19/h3,6-9,20H,4-5,10-16H2,1-2H3/p+1/b17-3+/t20-/m0/s1