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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)C2C(=O)N(CC(=O)N2CC3=CC=CC=C3)C4CCC(CC4)C)OC

Isomeric SMILES

CCCOC1=C(C=C(C=C1)C2C(=O)N(CC(=O)N2CC3=CC=CC=C3)C4CCC(CC4)C)OC

InChI

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