(3Z,6S)-3-(phenylmethylidene)-6-propan-2-yl-piperazine-2,5-dione

Systemtic Name: (3Z,6S)-3-(phenylmethylidene)-6-propan-2-yl-piperazine-2,5-dione Openeye Name: (3Z,6S)-3-benzylidene-6-isopropyl-piperazine-2,5-dione CAS Name: (3Z,6S)-3-(phenylmethylene)-6-propan-2-ylpiperazine-2,5-dione IUPAC Name: (3Z,6S)-3-benzylidene-6-propan-2-ylpiperazine-2,5-dione Traditional Name: (3Z,6S)-3-benzal-6-isopropyl-piperazine-2,5-quinone Formula: C14H16N2O2 MolecularWeight: 244.28904

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1C(=O)NC(=CC2=CC=CC=C2)C(=O)N1

Isomeric SMILES

CC(C)[C@H]1C(=O)N/C(=C\C2=CC=CC=C2)/C(=O)N1

InChI

InChI=1S/C14H16N2O2/c1-9(2)12-14(18)15-11(13(17)16-12)8-10-6-4-3-5-7-10/h3-9,12H,1-2H3,(H,15,18)(H,16,17)/b11-8-/t12-/m0/s1