2-[[(1S)-1-(4-methoxy-2-oxidanyl-phenyl)ethyl]azaniumyl]ethyl-methylsulfonyl-azanide

Systemtic Name: 2-[[(1S)-1-(4-methoxy-2-oxidanyl-phenyl)ethyl]azaniumyl]ethyl-methylsulfonyl-azanide Openeye Name: 2-[[(1S)-1-(2-hydroxy-4-methoxy-phenyl)ethyl]ammonio]ethyl-methylsulfonyl-azanide CAS Name: 2-[[(1S)-1-(2-hydroxy-4-methoxyphenyl)ethyl]ammonio]ethyl-methylsulfonylazanide IUPAC Name: 2-[[(1S)-1-(2-hydroxy-4-methoxyphenyl)ethyl]azaniumyl]ethyl-methylsulfonylazanide Traditional Name: 2-[[(1S)-1-(2-hydroxy-4-methoxy-phenyl)ethyl]ammonio]ethyl-mesyl-azanide Formula: C12H20N2O4S MolecularWeight: 288.3632

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=C(C=C(C=C1)OC)O)[NH2+]CC[N-]S(=O)(=O)C

Isomeric SMILES

C[C@@H](C1=C(C=C(C=C1)OC)O)[NH2+]CC[N-]S(=O)(=O)C

InChI

InChI=1S/C12H19N2O4S/c1-9(13-6-7-14-19(3,16)17)11-5-4-10(18-2)8-12(11)15/h4-5,8-9,13,15H,6-7H2,1-3H3/q-1/p+1/t9-/m0/s1