3-[(3-methoxy-4-methyl-phenyl)methyl]-1-(phenylmethyl)piperazine-2,5-dione

Systemtic Name: 3-[(3-methoxy-4-methyl-phenyl)methyl]-1-(phenylmethyl)piperazine-2,5-dione Openeye Name: 1-benzyl-3-[(3-methoxy-4-methyl-phenyl)methyl]piperazine-2,5-dione CAS Name: 3-[(3-methoxy-4-methylphenyl)methyl]-1-(phenylmethyl)piperazine-2,5-dione IUPAC Name: 1-benzyl-3-[(3-methoxy-4-methylphenyl)methyl]piperazine-2,5-dione Traditional Name: 1-benzyl-3-(3-methoxy-4-methyl-benzyl)piperazine-2,5-quinone Formula: C20H22N2O3 MolecularWeight: 338.40028

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)CC2C(=O)N(CC(=O)N2)CC3=CC=CC=C3)OC

Isomeric SMILES

CC1=C(C=C(C=C1)CC2C(=O)N(CC(=O)N2)CC3=CC=CC=C3)OC

InChI

InChI=1S/C20H22N2O3/c1-14-8-9-16(11-18(14)25-2)10-17-20(24)22(13-19(23)21-17)12-15-6-4-3-5-7-15/h3-9,11,17H,10,12-13H2,1-2H3,(H,21,23)