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1-(2,5-dimethylphenyl)-4-[(3S)-3-phenylbutyl]piperazin-4-ium

1-(2,5-dimethylphenyl)-4-[(3S)-3-phenylbutyl]piperazin-4-ium

Systemtic Name:1-(2,5-dimethylphenyl)-4-[(3S)-3-phenylbutyl]piperazin-4-ium
Openeye Name:1-(2,5-dimethylphenyl)-4-[(3S)-3-phenylbutyl]piperazin-4-ium
CAS Name:1-(2,5-dimethylphenyl)-4-[(3S)-3-phenylbutyl]piperazin-4-ium
IUPAC Name:1-(2,5-dimethylphenyl)-4-[(3S)-3-phenylbutyl]piperazin-4-ium
Traditional Name:1-(2,5-dimethylphenyl)-4-[(3S)-3-phenylbutyl]piperazin-4-ium
Formula: C22H31N2+
MolecularWeight: 323.49494
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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)N2CC[NH+](CC2)CCC(C)C3=CC=CC=C3


Isomeric SMILES

CC1=CC(=C(C=C1)C)N2CC[NH+](CC2)CC[C@H](C)C3=CC=CC=C3


InChI

InChI=1S/C22H30N2/c1-18-9-10-20(3)22(17-18)24-15-13-23(14-16-24)12-11-19(2)21-7-5-4-6-8-21/h4-10,17,19H,11-16H2,1-3H3/p+1/t19-/m0/s1


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