3-(4-pyrimidin-2-ylpiperazin-1-yl)carbonyl-4a,8a-dihydrochromen-2-one

Systemtic Name: 3-(4-pyrimidin-2-ylpiperazin-1-yl)carbonyl-4a,8a-dihydrochromen-2-one Openeye Name: 3-(4-pyrimidin-2-ylpiperazine-1-carbonyl)-4a,8a-dihydrochromen-2-one CAS Name: 3-[oxo-[4-(2-pyrimidinyl)-1-piperazinyl]methyl]-4a,8a-dihydro-1-benzopyran-2-one IUPAC Name: 3-(4-pyrimidin-2-ylpiperazine-1-carbonyl)-4a,8a-dihydrochromen-2-one Traditional Name: 3-[4-(2-pyrimidyl)piperazine-1-carbonyl]-4a,8a-dihydrochromen-2-one Formula: C18H18N4O3 MolecularWeight: 338.36052

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=CC=N2)C(=O)C3=CC4C=CC=CC4OC3=O

Isomeric SMILES

C1CN(CCN1C2=NC=CC=N2)C(=O)C3=CC4C=CC=CC4OC3=O

InChI

InChI=1S/C18H18N4O3/c23-16(14-12-13-4-1-2-5-15(13)25-17(14)24)21-8-10-22(11-9-21)18-19-6-3-7-20-18/h1-7,12-13,15H,8-11H2