(phenylmethyl) (3R)-3-(hydroxymethyl)piperazin-4-ium-1-carboxylate

Systemtic Name: (phenylmethyl) (3R)-3-(hydroxymethyl)piperazin-4-ium-1-carboxylate Openeye Name: benzyl (3R)-3-(hydroxymethyl)piperazin-4-ium-1-carboxylate CAS Name: (3R)-3-(hydroxymethyl)-1-piperazin-4-iumcarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl (3R)-3-(hydroxymethyl)piperazin-4-ium-1-carboxylate Traditional Name: (3R)-3-methylolpiperazin-4-ium-1-carboxylic acid benzyl ester Formula: C13H19N2O3+ MolecularWeight: 251.30156

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC([NH2+]1)CO)C(=O)OCC2=CC=CC=C2

Isomeric SMILES

C1CN(C[C@@H]([NH2+]1)CO)C(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C13H18N2O3/c16-9-12-8-15(7-6-14-12)13(17)18-10-11-4-2-1-3-5-11/h1-5,12,14,16H,6-10H2/p+1/t12-/m1/s1