(5S)-1-[(2S)-3-methyl-1-phenyl-pentan-2-yl]-4-phenethyl-5-(phenylmethyl)piperazine-2,3-dione

Systemtic Name: (5S)-1-[(2S)-3-methyl-1-phenyl-pentan-2-yl]-4-phenethyl-5-(phenylmethyl)piperazine-2,3-dione Openeye Name: (5S)-5-benzyl-1-[(1S)-1-benzyl-2-methyl-butyl]-4-phenethyl-piperazine-2,3-dione CAS Name: (5S)-1-[(2S)-3-methyl-1-phenylpentan-2-yl]-4-phenethyl-5-(phenylmethyl)piperazine-2,3-dione IUPAC Name: (5S)-5-benzyl-1-[(2S)-3-methyl-1-phenylpentan-2-yl]-4-phenethylpiperazine-2,3-dione Traditional Name: (5S)-5-benzyl-1-[(1S)-1-benzyl-2-methyl-butyl]-4-phenethyl-piperazine-2,3-quinone Formula: C31H36N2O2 MolecularWeight: 468.62974

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(CC1=CC=CC=C1)N2CC(N(C(=O)C2=O)CCC3=CC=CC=C3)CC4=CC=CC=C4

Isomeric SMILES

CCC(C)[C@H](CC1=CC=CC=C1)N2C[C@@H](N(C(=O)C2=O)CCC3=CC=CC=C3)CC4=CC=CC=C4

InChI

InChI=1S/C31H36N2O2/c1-3-24(2)29(22-27-17-11-6-12-18-27)33-23-28(21-26-15-9-5-10-16-26)32(30(34)31(33)35)20-19-25-13-7-4-8-14-25/h4-18,24,28-29H,3,19-23H2,1-2H3/t24?,28-,29-/m0/s1