2-[(2S)-2-oxidanylpropyl]-4-(phenylmethyl)piperazine-1-carboxylic acid

Systemtic Name: 2-[(2S)-2-oxidanylpropyl]-4-(phenylmethyl)piperazine-1-carboxylic acid Openeye Name: 4-benzyl-2-[(2S)-2-hydroxypropyl]piperazine-1-carboxylic acid CAS Name: 2-[(2S)-2-hydroxypropyl]-4-(phenylmethyl)-1-piperazinecarboxylic acid IUPAC Name: 4-benzyl-2-[(2S)-2-hydroxypropyl]piperazine-1-carboxylic acid Traditional Name: 4-benzyl-2-[(2S)-2-hydroxypropyl]piperazine-1-carboxylic acid Formula: C15H22N2O3 MolecularWeight: 278.34678

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1CN(CCN1C(=O)O)CC2=CC=CC=C2)O

Isomeric SMILES

C[C@@H](CC1CN(CCN1C(=O)O)CC2=CC=CC=C2)O

InChI

InChI=1S/C15H22N2O3/c1-12(18)9-14-11-16(7-8-17(14)15(19)20)10-13-5-3-2-4-6-13/h2-6,12,14,18H,7-11H2,1H3,(H,19,20)/t12-,14?/m0/s1