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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)CC2=CN=CN=C2N3CCC(=O)CC3)Cl

Isomeric SMILES

CC1=CC(=C(C=C1)CC2=CN=CN=C2N3CCC(=O)CC3)Cl

InChI

InChI=1S/C17H18ClN3O/c1-12-2-3-13(16(18)8-12)9-14-10-19-11-20-17(14)21-6-4-15(22)5-7-21/h2-3,8,10-11H,4-7,9H2,1H3