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N-(cyclohexylmethyl)-2-[4-(2,3-dimethylphenyl)piperazin-1-ium-1-yl]ethanamide

N-(cyclohexylmethyl)-2-[4-(2,3-dimethylphenyl)piperazin-1-ium-1-yl]ethanamide

Systemtic Name:N-(cyclohexylmethyl)-2-[4-(2,3-dimethylphenyl)piperazin-1-ium-1-yl]ethanamide
Openeye Name:N-(cyclohexylmethyl)-2-[4-(2,3-dimethylphenyl)piperazin-1-ium-1-yl]acetamide
CAS Name:N-(cyclohexylmethyl)-2-[4-(2,3-dimethylphenyl)-1-piperazin-1-iumyl]acetamide
IUPAC Name:N-(cyclohexylmethyl)-2-[4-(2,3-dimethylphenyl)piperazin-1-ium-1-yl]acetamide
Traditional Name:N-(cyclohexylmethyl)-2-[4-(2,3-dimethylphenyl)piperazin-1-ium-1-yl]acetamide
Formula: C21H34N3O+
MolecularWeight: 344.51416
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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N2CC[NH+](CC2)CC(=O)NCC3CCCCC3)C


Isomeric SMILES

CC1=C(C(=CC=C1)N2CC[NH+](CC2)CC(=O)NCC3CCCCC3)C


InChI

InChI=1S/C21H33N3O/c1-17-7-6-10-20(18(17)2)24-13-11-23(12-14-24)16-21(25)22-15-19-8-4-3-5-9-19/h6-7,10,19H,3-5,8-9,11-16H2,1-2H3,(H,22,25)/p+1


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