[(2S)-1-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-3-methyl-1-oxidanylidene-butan-2-yl]azanium

Systemtic Name: [(2S)-1-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-3-methyl-1-oxidanylidene-butan-2-yl]azanium Openeye Name: [(1S)-1-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamoyl)-2-methyl-propyl]ammonium CAS Name: [(2S)-1-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-3-methyl-1-oxobutan-2-yl]ammonium IUPAC Name: [(2S)-1-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-3-methyl-1-oxobutan-2-yl]azanium Traditional Name: [(1S)-1-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamoyl)-2-methyl-propyl]ammonium Formula: C13H19N2O3+ MolecularWeight: 251.30156

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC1=CC2=C(C=C1)OCCO2)[NH3+]

Isomeric SMILES

CC(C)[C@@H](C(=O)NC1=CC2=C(C=C1)OCCO2)[NH3+]

InChI

InChI=1S/C13H18N2O3/c1-8(2)12(14)13(16)15-9-3-4-10-11(7-9)18-6-5-17-10/h3-4,7-8,12H,5-6,14H2,1-2H3,(H,15,16)/p+1/t12-/m0/s1