(3R,6S)-3-(hydroxymethyl)-6-[(4-hydroxyphenyl)methyl]piperazine-2,5-dione

Systemtic Name: (3R,6S)-3-(hydroxymethyl)-6-[(4-hydroxyphenyl)methyl]piperazine-2,5-dione Openeye Name: (3R,6S)-3-(hydroxymethyl)-6-[(4-hydroxyphenyl)methyl]piperazine-2,5-dione CAS Name: (3R,6S)-3-(hydroxymethyl)-6-[(4-hydroxyphenyl)methyl]piperazine-2,5-dione IUPAC Name: (3R,6S)-3-(hydroxymethyl)-6-[(4-hydroxyphenyl)methyl]piperazine-2,5-dione Traditional Name: (3S,6R)-3-(4-hydroxybenzyl)-6-methylol-piperazine-2,5-quinone Formula: C12H14N2O4 MolecularWeight: 250.25056

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC2C(=O)NC(C(=O)N2)CO)O

Isomeric SMILES

C1=CC(=CC=C1C[C@H]2C(=O)N[C@@H](C(=O)N2)CO)O

InChI

InChI=1S/C12H14N2O4/c15-6-10-12(18)13-9(11(17)14-10)5-7-1-3-8(16)4-2-7/h1-4,9-10,15-16H,5-6H2,(H,13,18)(H,14,17)/t9-,10+/m0/s1