(3S)-1-[(4-methoxyphenyl)methyl]-3-methyl-piperazine-2,5-dione

Systemtic Name: (3S)-1-[(4-methoxyphenyl)methyl]-3-methyl-piperazine-2,5-dione Openeye Name: (3S)-1-[(4-methoxyphenyl)methyl]-3-methyl-piperazine-2,5-dione CAS Name: (3S)-1-[(4-methoxyphenyl)methyl]-3-methylpiperazine-2,5-dione IUPAC Name: (3S)-1-[(4-methoxyphenyl)methyl]-3-methylpiperazine-2,5-dione Traditional Name: (3S)-3-methyl-1-p-anisyl-piperazine-2,5-quinone Formula: C13H16N2O3 MolecularWeight: 248.27774

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)N(CC(=O)N1)CC2=CC=C(C=C2)OC

Isomeric SMILES

C[C@H]1C(=O)N(CC(=O)N1)CC2=CC=C(C=C2)OC

InChI

InChI=1S/C13H16N2O3/c1-9-13(17)15(8-12(16)14-9)7-10-3-5-11(18-2)6-4-10/h3-6,9H,7-8H2,1-2H3,(H,14,16)/t9-/m0/s1