[(3S)-3-methylpiperidin-1-yl]-[1-(phenylmethyl)pyrazol-4-yl]methanone

Systemtic Name: [(3S)-3-methylpiperidin-1-yl]-[1-(phenylmethyl)pyrazol-4-yl]methanone Openeye Name: (1-benzylpyrazol-4-yl)-[(3S)-3-methyl-1-piperidyl]methanone CAS Name: [(3S)-3-methyl-1-piperidinyl]-[1-(phenylmethyl)-4-pyrazolyl]methanone IUPAC Name: (1-benzylpyrazol-4-yl)-[(3S)-3-methylpiperidin-1-yl]methanone Traditional Name: (1-benzylpyrazol-4-yl)-[(3S)-3-methylpiperidino]methanone Formula: C17H21N3O MolecularWeight: 283.36814

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)C(=O)C2=CN(N=C2)CC3=CC=CC=C3

Isomeric SMILES

C[C@H]1CCCN(C1)C(=O)C2=CN(N=C2)CC3=CC=CC=C3

InChI

InChI=1S/C17H21N3O/c1-14-6-5-9-19(11-14)17(21)16-10-18-20(13-16)12-15-7-3-2-4-8-15/h2-4,7-8,10,13-14H,5-6,9,11-12H2,1H3/t14-/m0/s1