[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl-[2-(furan-2-ylmethylcarbamoylamino)-2-oxidanylidene-ethyl]-methyl-azanium

Systemtic Name: [(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl-[2-(furan-2-ylmethylcarbamoylamino)-2-oxidanylidene-ethyl]-methyl-azanium Openeye Name: [(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl-[2-(2-furylmethylcarbamoylamino)-2-oxo-ethyl]-methyl-ammonium CAS Name: [(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl-[2-[[(2-furanylmethylamino)-oxomethyl]amino]-2-oxoethyl]-methylammonium IUPAC Name: [(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl-[2-(furan-2-ylmethylcarbamoylamino)-2-oxoethyl]-methylazanium Traditional Name: [(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl-[2-(2-furfurylcarbamoylamino)-2-keto-ethyl]-methyl-ammonium Formula: C18H22N3O5+ MolecularWeight: 360.38438

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1COC2=CC=CC=C2O1)CC(=O)NC(=O)NCC3=CC=CO3

Isomeric SMILES

C[NH+](C[C@H]1COC2=CC=CC=C2O1)CC(=O)NC(=O)NCC3=CC=CO3

InChI

InChI=1S/C18H21N3O5/c1-21(10-14-12-25-15-6-2-3-7-16(15)26-14)11-17(22)20-18(23)19-9-13-5-4-8-24-13/h2-8,14H,9-12H2,1H3,(H2,19,20,22,23)/p+1/t14-/m0/s1