1-[5-[(2,4-dichlorophenyl)methyl]pyrimidin-4-yl]piperidin-3-one

Systemtic Name: 1-[5-[(2,4-dichlorophenyl)methyl]pyrimidin-4-yl]piperidin-3-one Openeye Name: 1-[5-[(2,4-dichlorophenyl)methyl]pyrimidin-4-yl]piperidin-3-one CAS Name: 1-[5-[(2,4-dichlorophenyl)methyl]-4-pyrimidinyl]-3-piperidinone IUPAC Name: 1-[5-[(2,4-dichlorophenyl)methyl]pyrimidin-4-yl]piperidin-3-one Traditional Name: 1-[5-(2,4-dichlorobenzyl)pyrimidin-4-yl]-3-piperidone Formula: C16H15Cl2N3O MolecularWeight: 336.2158

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)CN(C1)C2=NC=NC=C2CC3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

C1CC(=O)CN(C1)C2=NC=NC=C2CC3=C(C=C(C=C3)Cl)Cl

InChI

InChI=1S/C16H15Cl2N3O/c17-13-4-3-11(15(18)7-13)6-12-8-19-10-20-16(12)21-5-1-2-14(22)9-21/h3-4,7-8,10H,1-2,5-6,9H2