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

Systemtic Name: 3-(4-chlorophenyl)-7-[2-oxidanylidene-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethoxy]chromen-4-one Openeye Name: 3-(4-chlorophenyl)-7-[2-oxo-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethoxy]chromen-4-one CAS Name: 3-(4-chlorophenyl)-7-[2-oxo-2-[4-(2-pyrimidinyl)-1-piperazinyl]ethoxy]-1-benzopyran-4-one IUPAC Name: 3-(4-chlorophenyl)-7-[2-oxo-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethoxy]chromen-4-one Traditional Name: 3-(4-chlorophenyl)-7-[2-keto-2-[4-(2-pyrimidyl)piperazino]ethoxy]chromone Formula: C25H21ClN4O4 MolecularWeight: 476.91164

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=CC=N2)C(=O)COC3=CC4=C(C=C3)C(=O)C(=CO4)C5=CC=C(C=C5)Cl

Isomeric SMILES

C1CN(CCN1C2=NC=CC=N2)C(=O)COC3=CC4=C(C=C3)C(=O)C(=CO4)C5=CC=C(C=C5)Cl

InChI

InChI=1S/C25H21ClN4O4/c26-18-4-2-17(3-5-18)21-15-34-22-14-19(6-7-20(22)24(21)32)33-16-23(31)29-10-12-30(13-11-29)25-27-8-1-9-28-25/h1-9,14-15H,10-13,16H2