(E)-2-methyl-1-piperazin-1-yl-hept-2-ene-1,4,6-trione

Systemtic Name: (E)-2-methyl-1-piperazin-1-yl-hept-2-ene-1,4,6-trione Openeye Name: (E)-2-methyl-1-piperazin-1-yl-hept-2-ene-1,4,6-trione CAS Name: (E)-2-methyl-1-(1-piperazinyl)-2-heptene-1,4,6-trione IUPAC Name: (E)-2-methyl-1-piperazin-1-ylhept-2-ene-1,4,6-trione Traditional Name: (E)-2-methyl-1-piperazino-hept-2-ene-1,4,6-trione Formula: C12H18N2O3 MolecularWeight: 238.28292

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CC(=O)C=C(C)C(=O)N1CCNCC1

Isomeric SMILES

CC(=O)CC(=O)/C=C(\C)/C(=O)N1CCNCC1

InChI

InChI=1S/C12H18N2O3/c1-9(7-11(16)8-10(2)15)12(17)14-5-3-13-4-6-14/h7,13H,3-6,8H2,1-2H3/b9-7+