2-ethylsulfonyl-N-[2-(2-fluoranylphenoxy)ethyl]-N-methyl-3,4-dihydro-1H-isoquinoline-3-carboxamide

Systemtic Name: 2-ethylsulfonyl-N-[2-(2-fluoranylphenoxy)ethyl]-N-methyl-3,4-dihydro-1H-isoquinoline-3-carboxamide Openeye Name: 2-ethylsulfonyl-N-[2-(2-fluorophenoxy)ethyl]-N-methyl-3,4-dihydro-1H-isoquinoline-3-carboxamide CAS Name: 2-ethylsulfonyl-N-[2-(2-fluorophenoxy)ethyl]-N-methyl-3,4-dihydro-1H-isoquinoline-3-carboxamide IUPAC Name: 2-ethylsulfonyl-N-[2-(2-fluorophenoxy)ethyl]-N-methyl-3,4-dihydro-1H-isoquinoline-3-carboxamide Traditional Name: 2-esyl-N-[2-(2-fluorophenoxy)ethyl]-N-methyl-3,4-dihydro-1H-isoquinoline-3-carboxamide Formula: C21H25FN2O4S MolecularWeight: 420.497603

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N1CC2=CC=CC=C2CC1C(=O)N(C)CCOC3=CC=CC=C3F

Isomeric SMILES

CCS(=O)(=O)N1CC2=CC=CC=C2CC1C(=O)N(C)CCOC3=CC=CC=C3F

InChI

InChI=1S/C21H25FN2O4S/c1-3-29(26,27)24-15-17-9-5-4-8-16(17)14-19(24)21(25)23(2)12-13-28-20-11-7-6-10-18(20)22/h4-11,19H,3,12-15H2,1-2H3