N-(4-methylphenyl)-2-[4-(2-pyrrolidin-1-ium-1-ylethanoyl)piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-(4-methylphenyl)-2-[4-(2-pyrrolidin-1-ium-1-ylethanoyl)piperazin-1-ium-1-yl]ethanamide Openeye Name: N-(p-tolyl)-2-[4-(2-pyrrolidin-1-ium-1-ylacetyl)piperazin-1-ium-1-yl]acetamide CAS Name: N-(4-methylphenyl)-2-[4-[1-oxo-2-(1-pyrrolidin-1-iumyl)ethyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N-(4-methylphenyl)-2-[4-(2-pyrrolidin-1-ium-1-ylacetyl)piperazin-1-ium-1-yl]acetamide Traditional Name: N-(p-tolyl)-2-[4-(2-pyrrolidin-1-ium-1-ylacetyl)piperazin-1-ium-1-yl]acetamide Formula: C19H30N4O2+2 MolecularWeight: 346.4671

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)C[NH+]2CCN(CC2)C(=O)C[NH+]3CCCC3

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)C[NH+]2CCN(CC2)C(=O)C[NH+]3CCCC3

InChI

InChI=1S/C19H28N4O2/c1-16-4-6-17(7-5-16)20-18(24)14-22-10-12-23(13-11-22)19(25)15-21-8-2-3-9-21/h4-7H,2-3,8-15H2,1H3,(H,20,24)/p+2