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

Systemtic Name: 1-phenyl-4-[(3S)-1-[(E)-3-phenylprop-2-enyl]piperidin-1-ium-3-yl]piperazine Openeye Name: 1-[(3S)-1-[(E)-cinnamyl]piperidin-1-ium-3-yl]-4-phenyl-piperazine CAS Name: 1-phenyl-4-[(3S)-1-[(E)-3-phenylprop-2-enyl]-3-piperidin-1-iumyl]piperazine IUPAC Name: 1-phenyl-4-[(3S)-1-[(E)-3-phenylprop-2-enyl]piperidin-1-ium-3-yl]piperazine Traditional Name: 1-[(3S)-1-[(E)-cinnamyl]piperidin-1-ium-3-yl]-4-phenyl-piperazine Formula: C24H32N3+ MolecularWeight: 362.53098

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C[NH+](C1)CC=CC2=CC=CC=C2)N3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

C1C[C@@H](C[NH+](C1)C/C=C/C2=CC=CC=C2)N3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C24H31N3/c1-3-9-22(10-4-1)11-7-15-25-16-8-14-24(21-25)27-19-17-26(18-20-27)23-12-5-2-6-13-23/h1-7,9-13,24H,8,14-21H2/p+1/b11-7+/t24-/m0/s1