[2-(1,3-benzodioxol-5-ylamino)-2-oxidanylidene-ethyl]-(furan-2-ylmethyl)-methyl-azanium

Systemtic Name: [2-(1,3-benzodioxol-5-ylamino)-2-oxidanylidene-ethyl]-(furan-2-ylmethyl)-methyl-azanium Openeye Name: [2-(1,3-benzodioxol-5-ylamino)-2-oxo-ethyl]-(2-furylmethyl)-methyl-ammonium CAS Name: [2-(1,3-benzodioxol-5-ylamino)-2-oxoethyl]-(2-furanylmethyl)-methylammonium IUPAC Name: [2-(1,3-benzodioxol-5-ylamino)-2-oxoethyl]-(furan-2-ylmethyl)-methylazanium Traditional Name: [2-(1,3-benzodioxol-5-ylamino)-2-keto-ethyl]-(2-furfuryl)-methyl-ammonium Formula: C15H17N2O4+ MolecularWeight: 289.30648

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=CO1)CC(=O)NC2=CC3=C(C=C2)OCO3

Isomeric SMILES

C[NH+](CC1=CC=CO1)CC(=O)NC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C15H16N2O4/c1-17(8-12-3-2-6-19-12)9-15(18)16-11-4-5-13-14(7-11)21-10-20-13/h2-7H,8-10H2,1H3,(H,16,18)/p+1