1-[5-[(2-chloranyl-4-ethyl-phenyl)methyl]pyrimidin-4-yl]piperidin-3-one

Systemtic Name: 1-[5-[(2-chloranyl-4-ethyl-phenyl)methyl]pyrimidin-4-yl]piperidin-3-one Openeye Name: 1-[5-[(2-chloro-4-ethyl-phenyl)methyl]pyrimidin-4-yl]piperidin-3-one CAS Name: 1-[5-[(2-chloro-4-ethylphenyl)methyl]-4-pyrimidinyl]-3-piperidinone IUPAC Name: 1-[5-[(2-chloro-4-ethylphenyl)methyl]pyrimidin-4-yl]piperidin-3-one Traditional Name: 1-[5-(2-chloro-4-ethyl-benzyl)pyrimidin-4-yl]-3-piperidone Formula: C18H20ClN3O MolecularWeight: 329.8239

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C=C1)CC2=CN=CN=C2N3CCCC(=O)C3)Cl

Isomeric SMILES

CCC1=CC(=C(C=C1)CC2=CN=CN=C2N3CCCC(=O)C3)Cl

InChI

InChI=1S/C18H20ClN3O/c1-2-13-5-6-14(17(19)8-13)9-15-10-20-12-21-18(15)22-7-3-4-16(23)11-22/h5-6,8,10,12H,2-4,7,9,11H2,1H3