2-[methylsulfonyl(phenyl)amino]-N-pyridin-1-ium-3-yl-propanamide

Systemtic Name: 2-[methylsulfonyl(phenyl)amino]-N-pyridin-1-ium-3-yl-propanamide Openeye Name: 2-(N-methylsulfonylanilino)-N-pyridin-1-ium-3-yl-propanamide CAS Name: 2-(N-methylsulfonylanilino)-N-(3-pyridin-1-iumyl)propanamide IUPAC Name: 2-(N-methylsulfonylanilino)-N-pyridin-1-ium-3-ylpropanamide Traditional Name: 2-(N-mesylanilino)-N-pyridin-1-ium-3-yl-propionamide Formula: C15H18N3O3S+ MolecularWeight: 320.38672

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C[NH+]=CC=C1)N(C2=CC=CC=C2)S(=O)(=O)C

Isomeric SMILES

CC(C(=O)NC1=C[NH+]=CC=C1)N(C2=CC=CC=C2)S(=O)(=O)C

InChI

InChI=1S/C15H17N3O3S/c1-12(15(19)17-13-7-6-10-16-11-13)18(22(2,20)21)14-8-4-3-5-9-14/h3-12H,1-2H3,(H,17,19)/p+1