(5-chloranyl-2,3-dihydro-1,4-benzodioxin-7-yl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone

Systemtic Name: (5-chloranyl-2,3-dihydro-1,4-benzodioxin-7-yl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone Openeye Name: (5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone CAS Name: (5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)-[4-(2-pyrimidinyl)-1-piperazinyl]methanone IUPAC Name: (5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone Traditional Name: (5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)-[4-(2-pyrimidyl)piperazino]methanone Formula: C17H17ClN4O3 MolecularWeight: 360.79488

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=CC=N2)C(=O)C3=CC4=C(C(=C3)Cl)OCCO4

Isomeric SMILES

C1CN(CCN1C2=NC=CC=N2)C(=O)C3=CC4=C(C(=C3)Cl)OCCO4

InChI

InChI=1S/C17H17ClN4O3/c18-13-10-12(11-14-15(13)25-9-8-24-14)16(23)21-4-6-22(7-5-21)17-19-2-1-3-20-17/h1-3,10-11H,4-9H2