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

Systemtic Name: 3-(3-methoxy-4-propoxy-phenyl)-1-(4-methylcyclohexyl)-4-phenethyl-piperazine-2,5-dione Openeye Name: 3-(3-methoxy-4-propoxy-phenyl)-1-(4-methylcyclohexyl)-4-phenethyl-piperazine-2,5-dione CAS Name: 3-(3-methoxy-4-propoxyphenyl)-1-(4-methylcyclohexyl)-4-phenethylpiperazine-2,5-dione IUPAC Name: 3-(3-methoxy-4-propoxyphenyl)-1-(4-methylcyclohexyl)-4-phenethylpiperazine-2,5-dione Traditional Name: 3-(3-methoxy-4-propoxy-phenyl)-1-(4-methylcyclohexyl)-4-phenethyl-piperazine-2,5-quinone Formula: C29H38N2O4 MolecularWeight: 478.62302

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)C2C(=O)N(CC(=O)N2CCC3=CC=CC=C3)C4CCC(CC4)C)OC

Isomeric SMILES

CCCOC1=C(C=C(C=C1)C2C(=O)N(CC(=O)N2CCC3=CC=CC=C3)C4CCC(CC4)C)OC

InChI

InChI=1S/C29H38N2O4/c1-4-18-35-25-15-12-23(19-26(25)34-3)28-29(33)31(24-13-10-21(2)11-14-24)20-27(32)30(28)17-16-22-8-6-5-7-9-22/h5-9,12,15,19,21,24,28H,4,10-11,13-14,16-18,20H2,1-3H3