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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC2=C(C=C1)OC(C(C2N3CCN(CC3=O)C(=O)C4=CC=C(C=C4)F)O)(C)C

Isomeric SMILES

CC(=O)C1=CC2=C(C=C1)OC([C@H](C2N3CCN(CC3=O)C(=O)C4=CC=C(C=C4)F)O)(C)C

InChI

InChI=1S/C24H25FN2O5/c1-14(28)16-6-9-19-18(12-16)21(22(30)24(2,3)32-19)27-11-10-26(13-20(27)29)23(31)15-4-7-17(25)8-5-15/h4-9,12,21-22,30H,10-11,13H2,1-3H3/t21?,22-/m0/s1