1-[5-[(4-ethylphenyl)methyl]pyrimidin-4-yl]piperidin-3-one

Systemtic Name: 1-[5-[(4-ethylphenyl)methyl]pyrimidin-4-yl]piperidin-3-one Openeye Name: 1-[5-[(4-ethylphenyl)methyl]pyrimidin-4-yl]piperidin-3-one CAS Name: 1-[5-[(4-ethylphenyl)methyl]-4-pyrimidinyl]-3-piperidinone IUPAC Name: 1-[5-[(4-ethylphenyl)methyl]pyrimidin-4-yl]piperidin-3-one Traditional Name: 1-[5-(4-ethylbenzyl)pyrimidin-4-yl]-3-piperidone Formula: C18H21N3O MolecularWeight: 295.37884

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H21N3O/c1-2-14-5-7-15(8-6-14)10-16-11-19-13-20-18(16)21-9-3-4-17(22)12-21/h5-8,11,13H,2-4,9-10,12H2,1H3