[1-[(4-chloranyl-3-methyl-phenoxy)methyl]pyrazol-3-yl]-[(3S)-3-methylpiperidin-1-yl]methanone

Systemtic Name: [1-[(4-chloranyl-3-methyl-phenoxy)methyl]pyrazol-3-yl]-[(3S)-3-methylpiperidin-1-yl]methanone Openeye Name: [1-[(4-chloro-3-methyl-phenoxy)methyl]pyrazol-3-yl]-[(3S)-3-methyl-1-piperidyl]methanone CAS Name: [1-[(4-chloro-3-methylphenoxy)methyl]-3-pyrazolyl]-[(3S)-3-methyl-1-piperidinyl]methanone IUPAC Name: [1-[(4-chloro-3-methylphenoxy)methyl]pyrazol-3-yl]-[(3S)-3-methylpiperidin-1-yl]methanone Traditional Name: [1-[(4-chloro-3-methyl-phenoxy)methyl]pyrazol-3-yl]-[(3S)-3-methylpiperidino]methanone Formula: C18H22ClN3O2 MolecularWeight: 347.83918

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)C(=O)C2=NN(C=C2)COC3=CC(=C(C=C3)Cl)C

Isomeric SMILES

C[C@H]1CCCN(C1)C(=O)C2=NN(C=C2)COC3=CC(=C(C=C3)Cl)C

InChI

InChI=1S/C18H22ClN3O2/c1-13-4-3-8-21(11-13)18(23)17-7-9-22(20-17)12-24-15-5-6-16(19)14(2)10-15/h5-7,9-10,13H,3-4,8,11-12H2,1-2H3/t13-/m0/s1