1-[[(2S)-oxiran-2-yl]methyl]-4-(phenylmethyl)piperazin-4-ium

Systemtic Name: 1-[[(2S)-oxiran-2-yl]methyl]-4-(phenylmethyl)piperazin-4-ium Openeye Name: 1-benzyl-4-[[(2S)-oxiran-2-yl]methyl]piperazin-1-ium CAS Name: 1-[[(2S)-2-oxiranyl]methyl]-4-(phenylmethyl)piperazin-4-ium IUPAC Name: 1-benzyl-4-[[(2S)-oxiran-2-yl]methyl]piperazin-1-ium Traditional Name: 1-benzyl-4-[[(2S)-oxiran-2-yl]methyl]piperazin-1-ium Formula: C14H21N2O+ MolecularWeight: 233.32934

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=CC=C2)CC3CO3

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=CC=C2)C[C@H]3CO3

InChI

InChI=1S/C14H20N2O/c1-2-4-13(5-3-1)10-15-6-8-16(9-7-15)11-14-12-17-14/h1-5,14H,6-12H2/p+1/t14-/m0/s1