N-(3-chloranyl-2-methyl-phenyl)-4-cyclohexyl-piperazin-4-ium-1-carboxamide

Systemtic Name: N-(3-chloranyl-2-methyl-phenyl)-4-cyclohexyl-piperazin-4-ium-1-carboxamide Openeye Name: N-(3-chloro-2-methyl-phenyl)-4-cyclohexyl-piperazin-4-ium-1-carboxamide CAS Name: N-(3-chloro-2-methylphenyl)-4-cyclohexyl-1-piperazin-4-iumcarboxamide IUPAC Name: N-(3-chloro-2-methylphenyl)-4-cyclohexylpiperazin-4-ium-1-carboxamide Traditional Name: N-(3-chloro-2-methyl-phenyl)-4-cyclohexyl-piperazin-4-ium-1-carboxamide Formula: C18H27ClN3O+ MolecularWeight: 336.87948

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)NC(=O)N2CC[NH+](CC2)C3CCCCC3

Isomeric SMILES

CC1=C(C=CC=C1Cl)NC(=O)N2CC[NH+](CC2)C3CCCCC3

InChI

InChI=1S/C18H26ClN3O/c1-14-16(19)8-5-9-17(14)20-18(23)22-12-10-21(11-13-22)15-6-3-2-4-7-15/h5,8-9,15H,2-4,6-7,10-13H2,1H3,(H,20,23)/p+1