N-(3-ethoxypropyl)-2-[(2R)-3-oxidanylidene-1-(phenylmethyl)piperazin-1-ium-2-yl]ethanamide

Systemtic Name: N-(3-ethoxypropyl)-2-[(2R)-3-oxidanylidene-1-(phenylmethyl)piperazin-1-ium-2-yl]ethanamide Openeye Name: 2-[(2R)-1-benzyl-3-oxo-piperazin-1-ium-2-yl]-N-(3-ethoxypropyl)acetamide CAS Name: N-(3-ethoxypropyl)-2-[(2R)-3-oxo-1-(phenylmethyl)-2-piperazin-1-iumyl]acetamide IUPAC Name: 2-[(2R)-1-benzyl-3-oxopiperazin-1-ium-2-yl]-N-(3-ethoxypropyl)acetamide Traditional Name: 2-[(2R)-1-benzyl-3-keto-piperazin-1-ium-2-yl]-N-(3-ethoxypropyl)acetamide Formula: C18H28N3O3+ MolecularWeight: 334.43322

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCCNC(=O)CC1C(=O)NCC[NH+]1CC2=CC=CC=C2

Isomeric SMILES

CCOCCCNC(=O)C[C@@H]1C(=O)NCC[NH+]1CC2=CC=CC=C2

InChI

InChI=1S/C18H27N3O3/c1-2-24-12-6-9-19-17(22)13-16-18(23)20-10-11-21(16)14-15-7-4-3-5-8-15/h3-5,7-8,16H,2,6,9-14H2,1H3,(H,19,22)(H,20,23)/p+1/t16-/m1/s1