(2S)-4-(2-phenoxyethanoyl)piperazin-1-ium-2-carboxamide

Systemtic Name: (2S)-4-(2-phenoxyethanoyl)piperazin-1-ium-2-carboxamide Openeye Name: (2S)-4-(2-phenoxyacetyl)piperazin-1-ium-2-carboxamide CAS Name: (2S)-4-(1-oxo-2-phenoxyethyl)-2-piperazin-1-iumcarboxamide IUPAC Name: (2S)-4-(2-phenoxyacetyl)piperazin-1-ium-2-carboxamide Traditional Name: (2S)-4-(2-phenoxyacetyl)piperazin-1-ium-2-carboxamide Formula: C13H18N3O3+ MolecularWeight: 264.30032

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC([NH2+]1)C(=O)N)C(=O)COC2=CC=CC=C2

Isomeric SMILES

C1CN(C[C@H]([NH2+]1)C(=O)N)C(=O)COC2=CC=CC=C2

InChI

InChI=1S/C13H17N3O3/c14-13(18)11-8-16(7-6-15-11)12(17)9-19-10-4-2-1-3-5-10/h1-5,11,15H,6-9H2,(H2,14,18)/p+1/t11-/m0/s1