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

Systemtic Name: [(2S)-1-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethylamino]-3-methyl-1-oxidanylidene-butan-2-yl]azanium Openeye Name: [(1S)-1-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethylcarbamoyl]-2-methyl-propyl]ammonium CAS Name: [(2S)-1-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethylamino]-3-methyl-1-oxobutan-2-yl]ammonium IUPAC Name: [(2S)-1-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethylamino]-3-methyl-1-oxobutan-2-yl]azanium Traditional Name: [(1S)-1-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethylcarbamoyl]-2-methyl-propyl]ammonium Formula: C15H23N2O3+ MolecularWeight: 279.35472

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NCCC1=CC2=C(C=C1)OCCO2)[NH3+]

Isomeric SMILES

CC(C)[C@@H](C(=O)NCCC1=CC2=C(C=C1)OCCO2)[NH3+]

InChI

InChI=1S/C15H22N2O3/c1-10(2)14(16)15(18)17-6-5-11-3-4-12-13(9-11)20-8-7-19-12/h3-4,9-10,14H,5-8,16H2,1-2H3,(H,17,18)/p+1/t14-/m0/s1