1-(2,3-dimethylcyclohexyl)-3-(4-fluorophenyl)-4-phenethyl-piperazine-2,5-dione

Systemtic Name: 1-(2,3-dimethylcyclohexyl)-3-(4-fluorophenyl)-4-phenethyl-piperazine-2,5-dione Openeye Name: 1-(2,3-dimethylcyclohexyl)-3-(4-fluorophenyl)-4-phenethyl-piperazine-2,5-dione CAS Name: 1-(2,3-dimethylcyclohexyl)-3-(4-fluorophenyl)-4-phenethylpiperazine-2,5-dione IUPAC Name: 1-(2,3-dimethylcyclohexyl)-3-(4-fluorophenyl)-4-phenethylpiperazine-2,5-dione Traditional Name: 1-(2,3-dimethylcyclohexyl)-3-(4-fluorophenyl)-4-phenethyl-piperazine-2,5-quinone Formula: C26H31FN2O2 MolecularWeight: 422.534943

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(C1C)N2CC(=O)N(C(C2=O)C3=CC=C(C=C3)F)CCC4=CC=CC=C4

Isomeric SMILES

CC1CCCC(C1C)N2CC(=O)N(C(C2=O)C3=CC=C(C=C3)F)CCC4=CC=CC=C4

InChI

InChI=1S/C26H31FN2O2/c1-18-7-6-10-23(19(18)2)29-17-24(30)28(16-15-20-8-4-3-5-9-20)25(26(29)31)21-11-13-22(27)14-12-21/h3-5,8-9,11-14,18-19,23,25H,6-7,10,15-17H2,1-2H3