4-cyclohexyl-N-(3-ethanoylphenyl)piperazin-4-ium-1-carboxamide

Systemtic Name: 4-cyclohexyl-N-(3-ethanoylphenyl)piperazin-4-ium-1-carboxamide Openeye Name: N-(3-acetylphenyl)-4-cyclohexyl-piperazin-4-ium-1-carboxamide CAS Name: N-(3-acetylphenyl)-4-cyclohexyl-1-piperazin-4-iumcarboxamide IUPAC Name: N-(3-acetylphenyl)-4-cyclohexylpiperazin-4-ium-1-carboxamide Traditional Name: N-(3-acetylphenyl)-4-cyclohexyl-piperazin-4-ium-1-carboxamide Formula: C19H28N3O2+ MolecularWeight: 330.44452

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)NC(=O)N2CC[NH+](CC2)C3CCCCC3

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)NC(=O)N2CC[NH+](CC2)C3CCCCC3

InChI

InChI=1S/C19H27N3O2/c1-15(23)16-6-5-7-17(14-16)20-19(24)22-12-10-21(11-13-22)18-8-3-2-4-9-18/h5-7,14,18H,2-4,8-13H2,1H3,(H,20,24)/p+1