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

Systemtic Name: (3S)-3-[[4-(4-methoxy-3,5-dimethyl-phenyl)phenyl]methyl]-4-methyl-1-octyl-piperazine-2,5-dione Openeye Name: (3S)-3-[[4-(4-methoxy-3,5-dimethyl-phenyl)phenyl]methyl]-4-methyl-1-octyl-piperazine-2,5-dione CAS Name: (3S)-3-[[4-(4-methoxy-3,5-dimethylphenyl)phenyl]methyl]-4-methyl-1-octylpiperazine-2,5-dione IUPAC Name: (3S)-3-[[4-(4-methoxy-3,5-dimethylphenyl)phenyl]methyl]-4-methyl-1-octylpiperazine-2,5-dione Traditional Name: (3S)-3-[4-(4-methoxy-3,5-dimethyl-phenyl)benzyl]-4-methyl-1-octyl-piperazine-2,5-quinone Formula: C29H40N2O3 MolecularWeight: 464.6395

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCN1CC(=O)N(C(C1=O)CC2=CC=C(C=C2)C3=CC(=C(C(=C3)C)OC)C)C

Isomeric SMILES

CCCCCCCCN1CC(=O)N([C@H](C1=O)CC2=CC=C(C=C2)C3=CC(=C(C(=C3)C)OC)C)C

InChI

InChI=1S/C29H40N2O3/c1-6-7-8-9-10-11-16-31-20-27(32)30(4)26(29(31)33)19-23-12-14-24(15-13-23)25-17-21(2)28(34-5)22(3)18-25/h12-15,17-18,26H,6-11,16,19-20H2,1-5H3/t26-/m0/s1