2,2-dimethyl-5-oxidanyl-7-[2-oxidanylidene-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethoxy]-3H-chromen-4-one

Systemtic Name: 2,2-dimethyl-5-oxidanyl-7-[2-oxidanylidene-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethoxy]-3H-chromen-4-one Openeye Name: 5-hydroxy-2,2-dimethyl-7-[2-oxo-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethoxy]chroman-4-one CAS Name: 5-hydroxy-2,2-dimethyl-7-[2-oxo-2-[4-(2-pyrimidinyl)-1-piperazinyl]ethoxy]-3,4-dihydro-2H-1-benzopyran-4-one IUPAC Name: 5-hydroxy-2,2-dimethyl-7-[2-oxo-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethoxy]-3H-chromen-4-one Traditional Name: 5-hydroxy-7-[2-keto-2-[4-(2-pyrimidyl)piperazino]ethoxy]-2,2-dimethyl-chroman-4-one Formula: C21H24N4O5 MolecularWeight: 412.43906

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=O)C2=C(C=C(C=C2O1)OCC(=O)N3CCN(CC3)C4=NC=CC=N4)O)C

Isomeric SMILES

CC1(CC(=O)C2=C(C=C(C=C2O1)OCC(=O)N3CCN(CC3)C4=NC=CC=N4)O)C

InChI

InChI=1S/C21H24N4O5/c1-21(2)12-16(27)19-15(26)10-14(11-17(19)30-21)29-13-18(28)24-6-8-25(9-7-24)20-22-4-3-5-23-20/h3-5,10-11,26H,6-9,12-13H2,1-2H3