2-(4-aminocarbonylsulfonylphenyl)ethyl-[(5-methyl-1,2-oxazol-3-yl)carbonyl]azanium chloride

Systemtic Name: 2-(4-aminocarbonylsulfonylphenyl)ethyl-[(5-methyl-1,2-oxazol-3-yl)carbonyl]azanium chloride Openeye Name: 2-(4-carbamoylsulfonylphenyl)ethyl-(5-methylisoxazole-3-carbonyl)ammonium chloride CAS Name: 2-(4-carbamoylsulfonylphenyl)ethyl-[(5-methyl-3-isoxazolyl)-oxomethyl]ammonium chloride IUPAC Name: 2-(4-carbamoylsulfonylphenyl)ethyl-(5-methyl-1,2-oxazole-3-carbonyl)azanium chloride Traditional Name: 2-(4-carbamoylsulfonylphenyl)ethyl-(5-methylisoxazole-3-carbonyl)ammonium chloride Formula: C14H16ClN3O5S MolecularWeight: 373.81194

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)C(=O)[NH2+]CCC2=CC=C(C=C2)S(=O)(=O)C(=O)N.[Cl-]

Isomeric SMILES

CC1=CC(=NO1)C(=O)[NH2+]CCC2=CC=C(C=C2)S(=O)(=O)C(=O)N.[Cl-]

InChI

InChI=1S/C14H15N3O5S.ClH/c1-9-8-12(17-22-9)13(18)16-7-6-10-2-4-11(5-3-10)23(20,21)14(15)19;/h2-5,8H,6-7H2,1H3,(H2,15,19)(H,16,18);1H