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

Systemtic Name: N-(2-hydroxyethyl)-2-[(2R)-3-oxidanylidene-1-phenethyl-piperazin-1-ium-2-yl]-N-(phenylmethyl)ethanamide Openeye Name: N-benzyl-N-(2-hydroxyethyl)-2-[(2R)-3-oxo-1-phenethyl-piperazin-1-ium-2-yl]acetamide CAS Name: N-(2-hydroxyethyl)-2-[(2R)-3-oxo-1-phenethyl-2-piperazin-1-iumyl]-N-(phenylmethyl)acetamide IUPAC Name: N-benzyl-N-(2-hydroxyethyl)-2-[(2R)-3-oxo-1-phenethylpiperazin-1-ium-2-yl]acetamide Traditional Name: N-benzyl-N-(2-hydroxyethyl)-2-[(2R)-3-keto-1-phenethyl-piperazin-1-ium-2-yl]acetamide Formula: C23H30N3O3+ MolecularWeight: 396.5026

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](C(C(=O)N1)CC(=O)N(CCO)CC2=CC=CC=C2)CCC3=CC=CC=C3

Isomeric SMILES

C1C[NH+]([C@@H](C(=O)N1)CC(=O)N(CCO)CC2=CC=CC=C2)CCC3=CC=CC=C3

InChI

InChI=1S/C23H29N3O3/c27-16-15-26(18-20-9-5-2-6-10-20)22(28)17-21-23(29)24-12-14-25(21)13-11-19-7-3-1-4-8-19/h1-10,21,27H,11-18H2,(H,24,29)/p+1/t21-/m1/s1