7-[2-oxidanylidene-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethoxy]spiro[3H-chromene-2,1'-cyclohexane]-4-one

Systemtic Name: 7-[2-oxidanylidene-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethoxy]spiro[3H-chromene-2,1'-cyclohexane]-4-one Openeye Name: 7-[2-oxo-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethoxy]spiro[chromane-2,1'-cyclohexane]-4-one CAS Name: 7-[2-oxo-2-[4-(2-pyrimidinyl)-1-piperazinyl]ethoxy]-4-spiro[3,4-dihydro-2H-1-benzopyran-2,1'-cyclohexane]one IUPAC Name: 7-[2-oxo-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethoxy]spiro[3H-chromene-2,1'-cyclohexane]-4-one Traditional Name: 7-[2-keto-2-[4-(2-pyrimidyl)piperazino]ethoxy]spiro[chroman-2,1'-cyclohexane]-4-one Formula: C24H28N4O4 MolecularWeight: 436.50352

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2(CC1)CC(=O)C3=C(O2)C=C(C=C3)OCC(=O)N4CCN(CC4)C5=NC=CC=N5

Isomeric SMILES

C1CCC2(CC1)CC(=O)C3=C(O2)C=C(C=C3)OCC(=O)N4CCN(CC4)C5=NC=CC=N5

InChI

InChI=1S/C24H28N4O4/c29-20-16-24(7-2-1-3-8-24)32-21-15-18(5-6-19(20)21)31-17-22(30)27-11-13-28(14-12-27)23-25-9-4-10-26-23/h4-6,9-10,15H,1-3,7-8,11-14,16-17H2