(4-chloranyl-2-methyl-phenyl)-[(3S)-1-[(1-methylpyrazol-4-yl)methyl]piperidin-3-yl]methanone

Systemtic Name: (4-chloranyl-2-methyl-phenyl)-[(3S)-1-[(1-methylpyrazol-4-yl)methyl]piperidin-3-yl]methanone Openeye Name: (4-chloro-2-methyl-phenyl)-[(3S)-1-[(1-methylpyrazol-4-yl)methyl]-3-piperidyl]methanone CAS Name: (4-chloro-2-methylphenyl)-[(3S)-1-[(1-methyl-4-pyrazolyl)methyl]-3-piperidinyl]methanone IUPAC Name: (4-chloro-2-methylphenyl)-[(3S)-1-[(1-methylpyrazol-4-yl)methyl]piperidin-3-yl]methanone Traditional Name: (4-chloro-2-methyl-phenyl)-[(3S)-1-[(1-methylpyrazol-4-yl)methyl]-3-piperidyl]methanone Formula: C18H22ClN3O MolecularWeight: 331.83978

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Cl)C(=O)C2CCCN(C2)CC3=CN(N=C3)C

Isomeric SMILES

CC1=C(C=CC(=C1)Cl)C(=O)[C@H]2CCCN(C2)CC3=CN(N=C3)C

InChI

InChI=1S/C18H22ClN3O/c1-13-8-16(19)5-6-17(13)18(23)15-4-3-7-22(12-15)11-14-9-20-21(2)10-14/h5-6,8-10,15H,3-4,7,11-12H2,1-2H3/t15-/m0/s1