3-(4-chlorophenyl)-4-(furan-2-ylmethyl)-1-(2-methylcyclohexyl)piperazine-2,5-dione

Systemtic Name: 3-(4-chlorophenyl)-4-(furan-2-ylmethyl)-1-(2-methylcyclohexyl)piperazine-2,5-dione Openeye Name: 3-(4-chlorophenyl)-4-(2-furylmethyl)-1-(2-methylcyclohexyl)piperazine-2,5-dione CAS Name: 3-(4-chlorophenyl)-4-(2-furanylmethyl)-1-(2-methylcyclohexyl)piperazine-2,5-dione IUPAC Name: 3-(4-chlorophenyl)-4-(furan-2-ylmethyl)-1-(2-methylcyclohexyl)piperazine-2,5-dione Traditional Name: 3-(4-chlorophenyl)-4-(2-furfuryl)-1-(2-methylcyclohexyl)piperazine-2,5-quinone Formula: C22H25ClN2O3 MolecularWeight: 400.8985

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1N2CC(=O)N(C(C2=O)C3=CC=C(C=C3)Cl)CC4=CC=CO4

Isomeric SMILES

CC1CCCCC1N2CC(=O)N(C(C2=O)C3=CC=C(C=C3)Cl)CC4=CC=CO4

InChI

InChI=1S/C22H25ClN2O3/c1-15-5-2-3-7-19(15)24-14-20(26)25(13-18-6-4-12-28-18)21(22(24)27)16-8-10-17(23)11-9-16/h4,6,8-12,15,19,21H,2-3,5,7,13-14H2,1H3