N-[5-ethyl-3-(3-fluorophenyl)carbonyl-thiophen-2-yl]-2-morpholin-4-ium-4-yl-ethanamide

Systemtic Name: N-[5-ethyl-3-(3-fluorophenyl)carbonyl-thiophen-2-yl]-2-morpholin-4-ium-4-yl-ethanamide Openeye Name: N-[5-ethyl-3-(3-fluorobenzoyl)-2-thienyl]-2-morpholin-4-ium-4-yl-acetamide CAS Name: N-[5-ethyl-3-[(3-fluorophenyl)-oxomethyl]-2-thiophenyl]-2-(4-morpholin-4-iumyl)acetamide IUPAC Name: N-[5-ethyl-3-(3-fluorobenzoyl)thiophen-2-yl]-2-morpholin-4-ium-4-ylacetamide Traditional Name: N-[5-ethyl-3-(3-fluorobenzoyl)-2-thienyl]-2-morpholin-4-ium-4-yl-acetamide Formula: C19H22FN2O3S+ MolecularWeight: 377.452983

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(S1)NC(=O)C[NH+]2CCOCC2)C(=O)C3=CC(=CC=C3)F

Isomeric SMILES

CCC1=CC(=C(S1)NC(=O)C[NH+]2CCOCC2)C(=O)C3=CC(=CC=C3)F

InChI

InChI=1S/C19H21FN2O3S/c1-2-15-11-16(18(24)13-4-3-5-14(20)10-13)19(26-15)21-17(23)12-22-6-8-25-9-7-22/h3-5,10-11H,2,6-9,12H2,1H3,(H,21,23)/p+1