2-[4-[(2S)-oxolan-2-yl]carbonylpiperazin-1-ium-1-yl]-N-[(1S)-1-phenylethyl]ethanamide

Systemtic Name: 2-[4-[(2S)-oxolan-2-yl]carbonylpiperazin-1-ium-1-yl]-N-[(1S)-1-phenylethyl]ethanamide Openeye Name: N-[(1S)-1-phenylethyl]-2-[4-[(2S)-tetrahydrofuran-2-carbonyl]piperazin-1-ium-1-yl]acetamide CAS Name: 2-[4-[oxo-[(2S)-2-oxolanyl]methyl]-1-piperazin-1-iumyl]-N-[(1S)-1-phenylethyl]acetamide IUPAC Name: 2-[4-[(2S)-oxolane-2-carbonyl]piperazin-1-ium-1-yl]-N-[(1S)-1-phenylethyl]acetamide Traditional Name: N-[(1S)-1-phenylethyl]-2-[4-[(2S)-tetrahydrofuran-2-carbonyl]piperazin-1-ium-1-yl]acetamide Formula: C19H28N3O3+ MolecularWeight: 346.44392

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC(=O)C[NH+]2CCN(CC2)C(=O)C3CCCO3

Isomeric SMILES

C[C@@H](C1=CC=CC=C1)NC(=O)C[NH+]2CCN(CC2)C(=O)[C@@H]3CCCO3

InChI

InChI=1S/C19H27N3O3/c1-15(16-6-3-2-4-7-16)20-18(23)14-21-9-11-22(12-10-21)19(24)17-8-5-13-25-17/h2-4,6-7,15,17H,5,8-14H2,1H3,(H,20,23)/p+1/t15-,17-/m0/s1