4-cyclooctyl-3-(4-methoxyphenyl)-1-phenethyl-piperazine-2,5-dione

Systemtic Name: 4-cyclooctyl-3-(4-methoxyphenyl)-1-phenethyl-piperazine-2,5-dione Openeye Name: 4-cyclooctyl-3-(4-methoxyphenyl)-1-phenethyl-piperazine-2,5-dione CAS Name: 4-cyclooctyl-3-(4-methoxyphenyl)-1-phenethylpiperazine-2,5-dione IUPAC Name: 4-cyclooctyl-3-(4-methoxyphenyl)-1-phenethylpiperazine-2,5-dione Traditional Name: 4-cyclooctyl-3-(4-methoxyphenyl)-1-phenethyl-piperazine-2,5-quinone Formula: C27H34N2O3 MolecularWeight: 434.57046

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2C(=O)N(CC(=O)N2C3CCCCCCC3)CCC4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)C2C(=O)N(CC(=O)N2C3CCCCCCC3)CCC4=CC=CC=C4

InChI

InChI=1S/C27H34N2O3/c1-32-24-16-14-22(15-17-24)26-27(31)28(19-18-21-10-6-5-7-11-21)20-25(30)29(26)23-12-8-3-2-4-9-13-23/h5-7,10-11,14-17,23,26H,2-4,8-9,12-13,18-20H2,1H3