4-[(2,5-dimethylphenyl)sulfonylamino]-N-(1-ethylpiperidin-1-ium-4-yl)benzamide

Systemtic Name: 4-[(2,5-dimethylphenyl)sulfonylamino]-N-(1-ethylpiperidin-1-ium-4-yl)benzamide Openeye Name: 4-[(2,5-dimethylphenyl)sulfonylamino]-N-(1-ethylpiperidin-1-ium-4-yl)benzamide CAS Name: 4-[(2,5-dimethylphenyl)sulfonylamino]-N-(1-ethyl-4-piperidin-1-iumyl)benzamide IUPAC Name: 4-[(2,5-dimethylphenyl)sulfonylamino]-N-(1-ethylpiperidin-1-ium-4-yl)benzamide Traditional Name: 4-[(2,5-dimethylphenyl)sulfonylamino]-N-(1-ethylpiperidin-1-ium-4-yl)benzamide Formula: C22H30N3O3S+ MolecularWeight: 416.5569

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCC(CC1)NC(=O)C2=CC=C(C=C2)NS(=O)(=O)C3=C(C=CC(=C3)C)C

Isomeric SMILES

CC[NH+]1CCC(CC1)NC(=O)C2=CC=C(C=C2)NS(=O)(=O)C3=C(C=CC(=C3)C)C

InChI

InChI=1S/C22H29N3O3S/c1-4-25-13-11-19(12-14-25)23-22(26)18-7-9-20(10-8-18)24-29(27,28)21-15-16(2)5-6-17(21)3/h5-10,15,19,24H,4,11-14H2,1-3H3,(H,23,26)/p+1