1-(cyclohexylmethyl)-4-(2,3-dimethylphenyl)piperazin-1-ium

Systemtic Name: 1-(cyclohexylmethyl)-4-(2,3-dimethylphenyl)piperazin-1-ium Openeye Name: 1-(cyclohexylmethyl)-4-(2,3-dimethylphenyl)piperazin-1-ium CAS Name: 1-(cyclohexylmethyl)-4-(2,3-dimethylphenyl)piperazin-1-ium IUPAC Name: 1-(cyclohexylmethyl)-4-(2,3-dimethylphenyl)piperazin-1-ium Traditional Name: 1-(cyclohexylmethyl)-4-(2,3-dimethylphenyl)piperazin-1-ium Formula: C19H31N2+ MolecularWeight: 287.46284

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N2CC[NH+](CC2)CC3CCCCC3)C

Isomeric SMILES

CC1=C(C(=CC=C1)N2CC[NH+](CC2)CC3CCCCC3)C

InChI

InChI=1S/C19H30N2/c1-16-7-6-10-19(17(16)2)21-13-11-20(12-14-21)15-18-8-4-3-5-9-18/h6-7,10,18H,3-5,8-9,11-15H2,1-2H3/p+1