2-[4-(2-cyclopentylethanoyl)piperazin-1-ium-1-yl]-N-(2-ethanoylphenyl)ethanamide

Systemtic Name: 2-[4-(2-cyclopentylethanoyl)piperazin-1-ium-1-yl]-N-(2-ethanoylphenyl)ethanamide Openeye Name: N-(2-acetylphenyl)-2-[4-(2-cyclopentylacetyl)piperazin-1-ium-1-yl]acetamide CAS Name: N-(2-acetylphenyl)-2-[4-(2-cyclopentyl-1-oxoethyl)-1-piperazin-1-iumyl]acetamide IUPAC Name: N-(2-acetylphenyl)-2-[4-(2-cyclopentylacetyl)piperazin-1-ium-1-yl]acetamide Traditional Name: N-(2-acetylphenyl)-2-[4-(2-cyclopentylacetyl)piperazin-1-ium-1-yl]acetamide Formula: C21H30N3O3+ MolecularWeight: 372.4812

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=CC=C1NC(=O)C[NH+]2CCN(CC2)C(=O)CC3CCCC3

Isomeric SMILES

CC(=O)C1=CC=CC=C1NC(=O)C[NH+]2CCN(CC2)C(=O)CC3CCCC3

InChI

InChI=1S/C21H29N3O3/c1-16(25)18-8-4-5-9-19(18)22-20(26)15-23-10-12-24(13-11-23)21(27)14-17-6-2-3-7-17/h4-5,8-9,17H,2-3,6-7,10-15H2,1H3,(H,22,26)/p+1