2-[(4-chlorophenyl)-(4-methoxyphenyl)sulfonyl-amino]-N-[(1-methylpiperidin-1-ium-4-ylidene)amino]ethanamide

Systemtic Name: 2-[(4-chlorophenyl)-(4-methoxyphenyl)sulfonyl-amino]-N-[(1-methylpiperidin-1-ium-4-ylidene)amino]ethanamide Openeye Name: 2-(4-chloro-N-(4-methoxyphenyl)sulfonyl-anilino)-N-[(1-methylpiperidin-1-ium-4-ylidene)amino]acetamide CAS Name: 2-(4-chloro-N-(4-methoxyphenyl)sulfonylanilino)-N-[(1-methyl-4-piperidin-1-iumylidene)amino]acetamide IUPAC Name: 2-(4-chloro-N-(4-methoxyphenyl)sulfonylanilino)-N-[(1-methylpiperidin-1-ium-4-ylidene)amino]acetamide Traditional Name: 2-(4-chloro-N-(4-methoxyphenyl)sulfonyl-anilino)-N-[(1-methylpiperidin-1-ium-4-ylidene)amino]acetamide Formula: C21H26ClN4O4S+ MolecularWeight: 465.97354

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC(=NNC(=O)CN(C2=CC=C(C=C2)Cl)S(=O)(=O)C3=CC=C(C=C3)OC)CC1

Isomeric SMILES

C[NH+]1CCC(=NNC(=O)CN(C2=CC=C(C=C2)Cl)S(=O)(=O)C3=CC=C(C=C3)OC)CC1

InChI

InChI=1S/C21H25ClN4O4S/c1-25-13-11-17(12-14-25)23-24-21(27)15-26(18-5-3-16(22)4-6-18)31(28,29)20-9-7-19(30-2)8-10-20/h3-10H,11-15H2,1-2H3,(H,24,27)/p+1