[4-[(1S)-1-azaniumylethyl]phenyl]-[(5-methyl-1,2-oxazol-3-yl)methylsulfonyl]azanide

Systemtic Name: [4-[(1S)-1-azaniumylethyl]phenyl]-[(5-methyl-1,2-oxazol-3-yl)methylsulfonyl]azanide Openeye Name: [4-[(1S)-1-azaniumylethyl]phenyl]-[(5-methylisoxazol-3-yl)methylsulfonyl]azanide CAS Name: [4-[(1S)-1-ammonioethyl]phenyl]-[(5-methyl-3-isoxazolyl)methylsulfonyl]azanide IUPAC Name: [4-[(1S)-1-azaniumylethyl]phenyl]-[(5-methyl-1,2-oxazol-3-yl)methylsulfonyl]azanide Traditional Name: [4-[(1S)-1-ammonioethyl]phenyl]-[(5-methylisoxazol-3-yl)methylsulfonyl]azanide Formula: C13H17N3O3S MolecularWeight: 295.35738

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)CS(=O)(=O)[N-]C2=CC=C(C=C2)C(C)[NH3+]

Isomeric SMILES

CC1=CC(=NO1)CS(=O)(=O)[N-]C2=CC=C(C=C2)[C@H](C)[NH3+]

InChI

InChI=1S/C13H16N3O3S/c1-9-7-13(15-19-9)8-20(17,18)16-12-5-3-11(4-6-12)10(2)14/h3-7,10H,8,14H2,1-2H3/q-1/p+1/t10-/m0/s1