N-[3-(azepan-1-ylsulfonyl)phenyl]-2-(4-fluoranylphenoxy)propanamide

Systemtic Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-2-(4-fluoranylphenoxy)propanamide Openeye Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-2-(4-fluorophenoxy)propanamide CAS Name: N-[3-(1-azepanylsulfonyl)phenyl]-2-(4-fluorophenoxy)propanamide IUPAC Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-2-(4-fluorophenoxy)propanamide Traditional Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-2-(4-fluorophenoxy)propionamide Formula: C21H25FN2O4S MolecularWeight: 420.497603

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC(=CC=C1)S(=O)(=O)N2CCCCCC2)OC3=CC=C(C=C3)F

Isomeric SMILES

CC(C(=O)NC1=CC(=CC=C1)S(=O)(=O)N2CCCCCC2)OC3=CC=C(C=C3)F

InChI

InChI=1S/C21H25FN2O4S/c1-16(28-19-11-9-17(22)10-12-19)21(25)23-18-7-6-8-20(15-18)29(26,27)24-13-4-2-3-5-14-24/h6-12,15-16H,2-5,13-14H2,1H3,(H,23,25)