2-[(4-ethoxyphenyl)-(4-fluorophenyl)sulfonyl-amino]-N-(2-morpholin-4-ium-4-ylethyl)ethanamide

Systemtic Name: 2-[(4-ethoxyphenyl)-(4-fluorophenyl)sulfonyl-amino]-N-(2-morpholin-4-ium-4-ylethyl)ethanamide Openeye Name: 2-(4-ethoxy-N-(4-fluorophenyl)sulfonyl-anilino)-N-(2-morpholin-4-ium-4-ylethyl)acetamide CAS Name: 2-(4-ethoxy-N-(4-fluorophenyl)sulfonylanilino)-N-[2-(4-morpholin-4-iumyl)ethyl]acetamide IUPAC Name: 2-(4-ethoxy-N-(4-fluorophenyl)sulfonylanilino)-N-(2-morpholin-4-ium-4-ylethyl)acetamide Traditional Name: 2-(4-ethoxy-N-(4-fluorophenyl)sulfonyl-anilino)-N-(2-morpholin-4-ium-4-ylethyl)acetamide Formula: C22H29FN3O5S+ MolecularWeight: 466.546163

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N(CC(=O)NCC[NH+]2CCOCC2)S(=O)(=O)C3=CC=C(C=C3)F

Isomeric SMILES

CCOC1=CC=C(C=C1)N(CC(=O)NCC[NH+]2CCOCC2)S(=O)(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C22H28FN3O5S/c1-2-31-20-7-5-19(6-8-20)26(32(28,29)21-9-3-18(23)4-10-21)17-22(27)24-11-12-25-13-15-30-16-14-25/h3-10H,2,11-17H2,1H3,(H,24,27)/p+1