N-(2-methylpropyl)-2-[4-[2-oxidanylidene-2-(2-phenoxyethylamino)ethyl]piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-(2-methylpropyl)-2-[4-[2-oxidanylidene-2-(2-phenoxyethylamino)ethyl]piperazin-1-ium-1-yl]ethanamide Openeye Name: N-isobutyl-2-[4-[2-oxo-2-(2-phenoxyethylamino)ethyl]piperazin-1-ium-1-yl]acetamide CAS Name: N-(2-methylpropyl)-2-[4-[2-oxo-2-(2-phenoxyethylamino)ethyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N-(2-methylpropyl)-2-[4-[2-oxo-2-(2-phenoxyethylamino)ethyl]piperazin-1-ium-1-yl]acetamide Traditional Name: N-isobutyl-2-[4-[2-keto-2-(2-phenoxyethylamino)ethyl]piperazin-1-ium-1-yl]acetamide Formula: C20H33N4O3+ MolecularWeight: 377.50102

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)C[NH+]1CCN(CC1)CC(=O)NCCOC2=CC=CC=C2

Isomeric SMILES

CC(C)CNC(=O)C[NH+]1CCN(CC1)CC(=O)NCCOC2=CC=CC=C2

InChI

InChI=1S/C20H32N4O3/c1-17(2)14-22-20(26)16-24-11-9-23(10-12-24)15-19(25)21-8-13-27-18-6-4-3-5-7-18/h3-7,17H,8-16H2,1-2H3,(H,21,25)(H,22,26)/p+1