1,3-benzodioxol-5-yl-[(3S)-3-[4-(3-chlorophenyl)-1H-pyrazol-5-yl]piperidin-1-yl]methanone

Systemtic Name: 1,3-benzodioxol-5-yl-[(3S)-3-[4-(3-chlorophenyl)-1H-pyrazol-5-yl]piperidin-1-yl]methanone Openeye Name: 1,3-benzodioxol-5-yl-[(3S)-3-[4-(3-chlorophenyl)-1H-pyrazol-5-yl]-1-piperidyl]methanone CAS Name: 1,3-benzodioxol-5-yl-[(3S)-3-[4-(3-chlorophenyl)-1H-pyrazol-5-yl]-1-piperidinyl]methanone IUPAC Name: 1,3-benzodioxol-5-yl-[(3S)-3-[4-(3-chlorophenyl)-1H-pyrazol-5-yl]piperidin-1-yl]methanone Traditional Name: 1,3-benzodioxol-5-yl-[(3S)-3-[4-(3-chlorophenyl)-1H-pyrazol-5-yl]piperidino]methanone Formula: C22H20ClN3O3 MolecularWeight: 409.8655

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)C2=CC3=C(C=C2)OCO3)C4=C(C=NN4)C5=CC(=CC=C5)Cl

Isomeric SMILES

C1C[C@@H](CN(C1)C(=O)C2=CC3=C(C=C2)OCO3)C4=C(C=NN4)C5=CC(=CC=C5)Cl

InChI

InChI=1S/C22H20ClN3O3/c23-17-5-1-3-14(9-17)18-11-24-25-21(18)16-4-2-8-26(12-16)22(27)15-6-7-19-20(10-15)29-13-28-19/h1,3,5-7,9-11,16H,2,4,8,12-13H2,(H,24,25)/t16-/m0/s1