N-[2-(2-fluorophenyl)ethyl]-2,3-dimethoxy-5-morpholin-4-ylsulfonyl-benzamide

Systemtic Name: N-[2-(2-fluorophenyl)ethyl]-2,3-dimethoxy-5-morpholin-4-ylsulfonyl-benzamide Openeye Name: N-[2-(2-fluorophenyl)ethyl]-2,3-dimethoxy-5-morpholinosulfonyl-benzamide CAS Name: N-[2-(2-fluorophenyl)ethyl]-2,3-dimethoxy-5-(4-morpholinylsulfonyl)benzamide IUPAC Name: N-[2-(2-fluorophenyl)ethyl]-2,3-dimethoxy-5-morpholin-4-ylsulfonylbenzamide Traditional Name: N-[2-(2-fluorophenyl)ethyl]-2,3-dimethoxy-5-morpholinosulfonyl-benzamide Formula: C21H25FN2O6S MolecularWeight: 452.496403

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)S(=O)(=O)N2CCOCC2)C(=O)NCCC3=CC=CC=C3F)OC

Isomeric SMILES

COC1=C(C(=CC(=C1)S(=O)(=O)N2CCOCC2)C(=O)NCCC3=CC=CC=C3F)OC

InChI

InChI=1S/C21H25FN2O6S/c1-28-19-14-16(31(26,27)24-9-11-30-12-10-24)13-17(20(19)29-2)21(25)23-8-7-15-5-3-4-6-18(15)22/h3-6,13-14H,7-12H2,1-2H3,(H,23,25)