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

Systemtic Name: 1-[5-[(2-chloranyl-4-methyl-phenyl)methyl]pyrimidin-4-yl]piperidin-3-one Openeye Name: 1-[5-[(2-chloro-4-methyl-phenyl)methyl]pyrimidin-4-yl]piperidin-3-one CAS Name: 1-[5-[(2-chloro-4-methylphenyl)methyl]-4-pyrimidinyl]-3-piperidinone IUPAC Name: 1-[5-[(2-chloro-4-methylphenyl)methyl]pyrimidin-4-yl]piperidin-3-one Traditional Name: 1-[5-(2-chloro-4-methyl-benzyl)pyrimidin-4-yl]-3-piperidone Formula: C17H18ClN3O MolecularWeight: 315.79732

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)CC2=CN=CN=C2N3CCCC(=O)C3)Cl

Isomeric SMILES

CC1=CC(=C(C=C1)CC2=CN=CN=C2N3CCCC(=O)C3)Cl

InChI

InChI=1S/C17H18ClN3O/c1-12-4-5-13(16(18)7-12)8-14-9-19-11-20-17(14)21-6-2-3-15(22)10-21/h4-5,7,9,11H,2-3,6,8,10H2,1H3