3-(3-methoxy-4-propan-2-yloxy-phenyl)-1-(4-methylcyclohexyl)-4-(phenylmethyl)piperazine-2,5-dione

Systemtic Name: 3-(3-methoxy-4-propan-2-yloxy-phenyl)-1-(4-methylcyclohexyl)-4-(phenylmethyl)piperazine-2,5-dione Openeye Name: 4-benzyl-3-(4-isopropoxy-3-methoxy-phenyl)-1-(4-methylcyclohexyl)piperazine-2,5-dione CAS Name: 3-(3-methoxy-4-propan-2-yloxyphenyl)-1-(4-methylcyclohexyl)-4-(phenylmethyl)piperazine-2,5-dione IUPAC Name: 4-benzyl-3-(3-methoxy-4-propan-2-yloxyphenyl)-1-(4-methylcyclohexyl)piperazine-2,5-dione Traditional Name: 4-benzyl-3-(4-isopropoxy-3-methoxy-phenyl)-1-(4-methylcyclohexyl)piperazine-2,5-quinone Formula: C28H36N2O4 MolecularWeight: 464.59644

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(CC1)N2CC(=O)N(C(C2=O)C3=CC(=C(C=C3)OC(C)C)OC)CC4=CC=CC=C4

Isomeric SMILES

CC1CCC(CC1)N2CC(=O)N(C(C2=O)C3=CC(=C(C=C3)OC(C)C)OC)CC4=CC=CC=C4

InChI

InChI=1S/C28H36N2O4/c1-19(2)34-24-15-12-22(16-25(24)33-4)27-28(32)29(23-13-10-20(3)11-14-23)18-26(31)30(27)17-21-8-6-5-7-9-21/h5-9,12,15-16,19-20,23,27H,10-11,13-14,17-18H2,1-4H3