1-cycloheptyl-3-(4-ethoxy-3-methoxy-phenyl)-4-[(4-fluorophenyl)methyl]piperazine-2,5-dione

Systemtic Name: 1-cycloheptyl-3-(4-ethoxy-3-methoxy-phenyl)-4-[(4-fluorophenyl)methyl]piperazine-2,5-dione Openeye Name: 1-cycloheptyl-3-(4-ethoxy-3-methoxy-phenyl)-4-[(4-fluorophenyl)methyl]piperazine-2,5-dione CAS Name: 1-cycloheptyl-3-(4-ethoxy-3-methoxyphenyl)-4-[(4-fluorophenyl)methyl]piperazine-2,5-dione IUPAC Name: 1-cycloheptyl-3-(4-ethoxy-3-methoxyphenyl)-4-[(4-fluorophenyl)methyl]piperazine-2,5-dione Traditional Name: 1-cycloheptyl-3-(4-ethoxy-3-methoxy-phenyl)-4-(4-fluorobenzyl)piperazine-2,5-quinone Formula: C27H33FN2O4 MolecularWeight: 468.560323

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C2C(=O)N(CC(=O)N2CC3=CC=C(C=C3)F)C4CCCCCC4)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C2C(=O)N(CC(=O)N2CC3=CC=C(C=C3)F)C4CCCCCC4)OC

InChI

InChI=1S/C27H33FN2O4/c1-3-34-23-15-12-20(16-24(23)33-2)26-27(32)29(22-8-6-4-5-7-9-22)18-25(31)30(26)17-19-10-13-21(28)14-11-19/h10-16,22,26H,3-9,17-18H2,1-2H3