2-chloranyl-N-(2-ethylsulfonyl-3,4-dihydro-1H-isoquinolin-7-yl)-6-fluoranyl-benzamide

Systemtic Name: 2-chloranyl-N-(2-ethylsulfonyl-3,4-dihydro-1H-isoquinolin-7-yl)-6-fluoranyl-benzamide Openeye Name: 2-chloro-N-(2-ethylsulfonyl-3,4-dihydro-1H-isoquinolin-7-yl)-6-fluoro-benzamide CAS Name: 2-chloro-N-(2-ethylsulfonyl-3,4-dihydro-1H-isoquinolin-7-yl)-6-fluorobenzamide IUPAC Name: 2-chloro-N-(2-ethylsulfonyl-3,4-dihydro-1H-isoquinolin-7-yl)-6-fluorobenzamide Traditional Name: 2-chloro-N-(2-esyl-3,4-dihydro-1H-isoquinolin-7-yl)-6-fluoro-benzamide Formula: C18H18ClFN2O3S MolecularWeight: 396.863523

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N1CCC2=C(C1)C=C(C=C2)NC(=O)C3=C(C=CC=C3Cl)F

Isomeric SMILES

CCS(=O)(=O)N1CCC2=C(C1)C=C(C=C2)NC(=O)C3=C(C=CC=C3Cl)F

InChI

InChI=1S/C18H18ClFN2O3S/c1-2-26(24,25)22-9-8-12-6-7-14(10-13(12)11-22)21-18(23)17-15(19)4-3-5-16(17)20/h3-7,10H,2,8-9,11H2,1H3,(H,21,23)