3-(6-ethanoyl-2,2-dimethyl-3-oxidanyl-3,4-dihydrochromen-4-yl)-1-(4-fluorophenyl)carbonyl-piperazin-2-one

Systemtic Name: 3-(6-ethanoyl-2,2-dimethyl-3-oxidanyl-3,4-dihydrochromen-4-yl)-1-(4-fluorophenyl)carbonyl-piperazin-2-one Openeye Name: 3-(6-acetyl-3-hydroxy-2,2-dimethyl-chroman-4-yl)-1-(4-fluorobenzoyl)piperazin-2-one CAS Name: 3-(6-acetyl-3-hydroxy-2,2-dimethyl-3,4-dihydro-2H-1-benzopyran-4-yl)-1-[(4-fluorophenyl)-oxomethyl]-2-piperazinone IUPAC Name: 3-(6-acetyl-3-hydroxy-2,2-dimethyl-3,4-dihydrochromen-4-yl)-1-(4-fluorobenzoyl)piperazin-2-one Traditional Name: 3-(6-acetyl-3-hydroxy-2,2-dimethyl-chroman-4-yl)-1-(4-fluorobenzoyl)piperazin-2-one Formula: C24H25FN2O5 MolecularWeight: 440.464103

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC2=C(C=C1)OC(C(C2C3C(=O)N(CCN3)C(=O)C4=CC=C(C=C4)F)O)(C)C

Isomeric SMILES

CC(=O)C1=CC2=C(C=C1)OC(C(C2C3C(=O)N(CCN3)C(=O)C4=CC=C(C=C4)F)O)(C)C

InChI

InChI=1S/C24H25FN2O5/c1-13(28)15-6-9-18-17(12-15)19(21(29)24(2,3)32-18)20-23(31)27(11-10-26-20)22(30)14-4-7-16(25)8-5-14/h4-9,12,19-21,26,29H,10-11H2,1-3H3