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

Systemtic Name: 2,2-dimethyl-7-[2-oxidanylidene-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethoxy]-3H-chromen-4-one Openeye Name: 2,2-dimethyl-7-[2-oxo-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethoxy]chroman-4-one CAS Name: 2,2-dimethyl-7-[2-oxo-2-[4-(2-pyrimidinyl)-1-piperazinyl]ethoxy]-3,4-dihydro-2H-1-benzopyran-4-one IUPAC Name: 2,2-dimethyl-7-[2-oxo-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethoxy]-3H-chromen-4-one Traditional Name: 7-[2-keto-2-[4-(2-pyrimidyl)piperazino]ethoxy]-2,2-dimethyl-chroman-4-one Formula: C21H24N4O4 MolecularWeight: 396.43966

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=O)C2=C(O1)C=C(C=C2)OCC(=O)N3CCN(CC3)C4=NC=CC=N4)C

Isomeric SMILES

CC1(CC(=O)C2=C(O1)C=C(C=C2)OCC(=O)N3CCN(CC3)C4=NC=CC=N4)C

InChI

InChI=1S/C21H24N4O4/c1-21(2)13-17(26)16-5-4-15(12-18(16)29-21)28-14-19(27)24-8-10-25(11-9-24)20-22-6-3-7-23-20/h3-7,12H,8-11,13-14H2,1-2H3