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

Systemtic Name: 1-(3-chlorophenyl)-4-[(3S)-1-[(E)-3-phenylprop-2-enyl]piperidin-1-ium-3-yl]piperazine Openeye Name: 1-(3-chlorophenyl)-4-[(3S)-1-[(E)-cinnamyl]piperidin-1-ium-3-yl]piperazine CAS Name: 1-(3-chlorophenyl)-4-[(3S)-1-[(E)-3-phenylprop-2-enyl]-3-piperidin-1-iumyl]piperazine IUPAC Name: 1-(3-chlorophenyl)-4-[(3S)-1-[(E)-3-phenylprop-2-enyl]piperidin-1-ium-3-yl]piperazine Traditional Name: 1-(3-chlorophenyl)-4-[(3S)-1-[(E)-cinnamyl]piperidin-1-ium-3-yl]piperazine Formula: C24H31ClN3+ MolecularWeight: 396.97604

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H30ClN3/c25-22-10-4-11-23(19-22)27-15-17-28(18-16-27)24-12-6-14-26(20-24)13-5-9-21-7-2-1-3-8-21/h1-5,7-11,19,24H,6,12-18,20H2/p+1/b9-5+/t24-/m0/s1