2-[(4-methoxyphenyl)sulfonyl-phenyl-amino]-N-(3-morpholin-4-ium-4-ylpropyl)ethanamide

Systemtic Name: 2-[(4-methoxyphenyl)sulfonyl-phenyl-amino]-N-(3-morpholin-4-ium-4-ylpropyl)ethanamide Openeye Name: 2-(N-(4-methoxyphenyl)sulfonylanilino)-N-(3-morpholin-4-ium-4-ylpropyl)acetamide CAS Name: 2-(N-(4-methoxyphenyl)sulfonylanilino)-N-[3-(4-morpholin-4-iumyl)propyl]acetamide IUPAC Name: 2-(N-(4-methoxyphenyl)sulfonylanilino)-N-(3-morpholin-4-ium-4-ylpropyl)acetamide Traditional Name: 2-(N-(4-methoxyphenyl)sulfonylanilino)-N-(3-morpholin-4-ium-4-ylpropyl)acetamide Formula: C22H30N3O5S+ MolecularWeight: 448.5557

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)N(CC(=O)NCCC[NH+]2CCOCC2)C3=CC=CC=C3

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)N(CC(=O)NCCC[NH+]2CCOCC2)C3=CC=CC=C3

InChI

InChI=1S/C22H29N3O5S/c1-29-20-8-10-21(11-9-20)31(27,28)25(19-6-3-2-4-7-19)18-22(26)23-12-5-13-24-14-16-30-17-15-24/h2-4,6-11H,5,12-18H2,1H3,(H,23,26)/p+1