3-[(2,5-dimethylphenyl)sulfonylamino]-N-(3-piperidin-1-ium-1-ylpropyl)benzamide

Systemtic Name: 3-[(2,5-dimethylphenyl)sulfonylamino]-N-(3-piperidin-1-ium-1-ylpropyl)benzamide Openeye Name: 3-[(2,5-dimethylphenyl)sulfonylamino]-N-(3-piperidin-1-ium-1-ylpropyl)benzamide CAS Name: 3-[(2,5-dimethylphenyl)sulfonylamino]-N-[3-(1-piperidin-1-iumyl)propyl]benzamide IUPAC Name: 3-[(2,5-dimethylphenyl)sulfonylamino]-N-(3-piperidin-1-ium-1-ylpropyl)benzamide Traditional Name: 3-[(2,5-dimethylphenyl)sulfonylamino]-N-(3-piperidin-1-ium-1-ylpropyl)benzamide Formula: C23H32N3O3S+ MolecularWeight: 430.58348

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)S(=O)(=O)NC2=CC=CC(=C2)C(=O)NCCC[NH+]3CCCCC3

Isomeric SMILES

CC1=CC(=C(C=C1)C)S(=O)(=O)NC2=CC=CC(=C2)C(=O)NCCC[NH+]3CCCCC3

InChI

InChI=1S/C23H31N3O3S/c1-18-10-11-19(2)22(16-18)30(28,29)25-21-9-6-8-20(17-21)23(27)24-12-7-15-26-13-4-3-5-14-26/h6,8-11,16-17,25H,3-5,7,12-15H2,1-2H3,(H,24,27)/p+1