(3S,6S)-6-butyl-1-methyl-3-(phenylmethyl)-4-prop-2-ynyl-piperazine-2,5-dione

Systemtic Name: (3S,6S)-6-butyl-1-methyl-3-(phenylmethyl)-4-prop-2-ynyl-piperazine-2,5-dione Openeye Name: (3S,6S)-3-benzyl-6-butyl-1-methyl-4-prop-2-ynyl-piperazine-2,5-dione CAS Name: (3S,6S)-6-butyl-1-methyl-3-(phenylmethyl)-4-prop-2-ynylpiperazine-2,5-dione IUPAC Name: (3S,6S)-3-benzyl-6-butyl-1-methyl-4-prop-2-ynylpiperazine-2,5-dione Traditional Name: (3S,6S)-3-benzyl-6-butyl-1-methyl-4-propargyl-piperazine-2,5-quinone Formula: C19H24N2O2 MolecularWeight: 312.40606

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1C(=O)N(C(C(=O)N1C)CC2=CC=CC=C2)CC#C

Isomeric SMILES

CCCC[C@H]1C(=O)N([C@H](C(=O)N1C)CC2=CC=CC=C2)CC#C

InChI

InChI=1S/C19H24N2O2/c1-4-6-12-16-19(23)21(13-5-2)17(18(22)20(16)3)14-15-10-8-7-9-11-15/h2,7-11,16-17H,4,6,12-14H2,1,3H3/t16-,17-/m0/s1