2-(3,4-dimethoxyphenyl)sulfonyl-N-(2-fluoranylethyl)-3,4-dihydro-1H-isoquinoline-3-carboxamide

Systemtic Name: 2-(3,4-dimethoxyphenyl)sulfonyl-N-(2-fluoranylethyl)-3,4-dihydro-1H-isoquinoline-3-carboxamide Openeye Name: 2-(3,4-dimethoxyphenyl)sulfonyl-N-(2-fluoroethyl)-3,4-dihydro-1H-isoquinoline-3-carboxamide CAS Name: 2-(3,4-dimethoxyphenyl)sulfonyl-N-(2-fluoroethyl)-3,4-dihydro-1H-isoquinoline-3-carboxamide IUPAC Name: 2-(3,4-dimethoxyphenyl)sulfonyl-N-(2-fluoroethyl)-3,4-dihydro-1H-isoquinoline-3-carboxamide Traditional Name: 2-(3,4-dimethoxyphenyl)sulfonyl-N-(2-fluoroethyl)-3,4-dihydro-1H-isoquinoline-3-carboxamide Formula: C20H23FN2O5S MolecularWeight: 422.470423

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CC3=CC=CC=C3CC2C(=O)NCCF)OC

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CC3=CC=CC=C3CC2C(=O)NCCF)OC

InChI

InChI=1S/C20H23FN2O5S/c1-27-18-8-7-16(12-19(18)28-2)29(25,26)23-13-15-6-4-3-5-14(15)11-17(23)20(24)22-10-9-21/h3-8,12,17H,9-11,13H2,1-2H3,(H,22,24)