1,3-benzodioxol-5-yl-[(3S)-1-[(8-fluoranylquinolin-2-yl)methyl]piperidin-3-yl]methanone

Systemtic Name: 1,3-benzodioxol-5-yl-[(3S)-1-[(8-fluoranylquinolin-2-yl)methyl]piperidin-3-yl]methanone Openeye Name: 1,3-benzodioxol-5-yl-[(3S)-1-[(8-fluoro-2-quinolyl)methyl]-3-piperidyl]methanone CAS Name: 1,3-benzodioxol-5-yl-[(3S)-1-[(8-fluoro-2-quinolinyl)methyl]-3-piperidinyl]methanone IUPAC Name: 1,3-benzodioxol-5-yl-[(3S)-1-[(8-fluoroquinolin-2-yl)methyl]piperidin-3-yl]methanone Traditional Name: 1,3-benzodioxol-5-yl-[(3S)-1-[(8-fluoro-2-quinolyl)methyl]-3-piperidyl]methanone Formula: C23H21FN2O3 MolecularWeight: 392.422843

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)CC2=NC3=C(C=CC=C3F)C=C2)C(=O)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

C1C[C@@H](CN(C1)CC2=NC3=C(C=CC=C3F)C=C2)C(=O)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C23H21FN2O3/c24-19-5-1-3-15-6-8-18(25-22(15)19)13-26-10-2-4-17(12-26)23(27)16-7-9-20-21(11-16)29-14-28-20/h1,3,5-9,11,17H,2,4,10,12-14H2/t17-/m0/s1