2-[(3-chlorophenyl)-(4-methoxyphenyl)sulfonyl-amino]-N-(2-morpholin-4-ium-4-ylethyl)ethanamide

Systemtic Name: 2-[(3-chlorophenyl)-(4-methoxyphenyl)sulfonyl-amino]-N-(2-morpholin-4-ium-4-ylethyl)ethanamide Openeye Name: 2-(3-chloro-N-(4-methoxyphenyl)sulfonyl-anilino)-N-(2-morpholin-4-ium-4-ylethyl)acetamide CAS Name: 2-(3-chloro-N-(4-methoxyphenyl)sulfonylanilino)-N-[2-(4-morpholin-4-iumyl)ethyl]acetamide IUPAC Name: 2-(3-chloro-N-(4-methoxyphenyl)sulfonylanilino)-N-(2-morpholin-4-ium-4-ylethyl)acetamide Traditional Name: 2-(3-chloro-N-(4-methoxyphenyl)sulfonyl-anilino)-N-(2-morpholin-4-ium-4-ylethyl)acetamide Formula: C21H27ClN3O5S+ MolecularWeight: 468.97418

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H26ClN3O5S/c1-29-19-5-7-20(8-6-19)31(27,28)25(18-4-2-3-17(22)15-18)16-21(26)23-9-10-24-11-13-30-14-12-24/h2-8,15H,9-14,16H2,1H3,(H,23,26)/p+1