1-(phenylmethyl)-3-prop-2-ynyl-piperazine-2,5-dione

Systemtic Name: 1-(phenylmethyl)-3-prop-2-ynyl-piperazine-2,5-dione Openeye Name: 1-benzyl-3-prop-2-ynyl-piperazine-2,5-dione CAS Name: 1-(phenylmethyl)-3-prop-2-ynylpiperazine-2,5-dione IUPAC Name: 1-benzyl-3-prop-2-ynylpiperazine-2,5-dione Traditional Name: 1-benzyl-3-propargyl-piperazine-2,5-quinone Formula: C14H14N2O2 MolecularWeight: 242.27316

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Descriptors Computed from Structure

Canonical SMILES:

C#CCC1C(=O)N(CC(=O)N1)CC2=CC=CC=C2

Isomeric SMILES

C#CCC1C(=O)N(CC(=O)N1)CC2=CC=CC=C2

InChI

InChI=1S/C14H14N2O2/c1-2-6-12-14(18)16(10-13(17)15-12)9-11-7-4-3-5-8-11/h1,3-5,7-8,12H,6,9-10H2,(H,15,17)