[1-(3-chloranyl-4-fluoranyl-phenyl)sulfonylpiperidin-4-yl]-(3,4-dihydro-1H-isoquinolin-2-yl)methanone

Systemtic Name: [1-(3-chloranyl-4-fluoranyl-phenyl)sulfonylpiperidin-4-yl]-(3,4-dihydro-1H-isoquinolin-2-yl)methanone Openeye Name: [1-(3-chloro-4-fluoro-phenyl)sulfonyl-4-piperidyl]-(3,4-dihydro-1H-isoquinolin-2-yl)methanone CAS Name: [1-(3-chloro-4-fluorophenyl)sulfonyl-4-piperidinyl]-(3,4-dihydro-1H-isoquinolin-2-yl)methanone IUPAC Name: [1-(3-chloro-4-fluorophenyl)sulfonylpiperidin-4-yl]-(3,4-dihydro-1H-isoquinolin-2-yl)methanone Traditional Name: [1-(3-chloro-4-fluoro-phenyl)sulfonyl-4-piperidyl]-(3,4-dihydro-1H-isoquinolin-2-yl)methanone Formula: C21H22ClFN2O3S MolecularWeight: 436.927383

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)N2CCC3=CC=CC=C3C2)S(=O)(=O)C4=CC(=C(C=C4)F)Cl

Isomeric SMILES

C1CN(CCC1C(=O)N2CCC3=CC=CC=C3C2)S(=O)(=O)C4=CC(=C(C=C4)F)Cl

InChI

InChI=1S/C21H22ClFN2O3S/c22-19-13-18(5-6-20(19)23)29(27,28)25-11-8-16(9-12-25)21(26)24-10-7-15-3-1-2-4-17(15)14-24/h1-6,13,16H,7-12,14H2