2-[[5-[(6-ethanoyl-3-oxidanylidene-1,4-benzoxazin-4-yl)methyl]furan-2-yl]carbonylamino]ethyl-dimethyl-azanium

Systemtic Name: 2-[[5-[(6-ethanoyl-3-oxidanylidene-1,4-benzoxazin-4-yl)methyl]furan-2-yl]carbonylamino]ethyl-dimethyl-azanium Openeye Name: 2-[[5-[(6-acetyl-3-oxo-1,4-benzoxazin-4-yl)methyl]furan-2-carbonyl]amino]ethyl-dimethyl-ammonium CAS Name: 2-[[[5-[(6-acetyl-3-oxo-1,4-benzoxazin-4-yl)methyl]-2-furanyl]-oxomethyl]amino]ethyl-dimethylammonium IUPAC Name: 2-[[5-[(6-acetyl-3-oxo-1,4-benzoxazin-4-yl)methyl]furan-2-carbonyl]amino]ethyl-dimethylazanium Traditional Name: 2-[[5-[(6-acetyl-3-keto-1,4-benzoxazin-4-yl)methyl]-2-furoyl]amino]ethyl-dimethyl-ammonium Formula: C20H24N3O5+ MolecularWeight: 386.42166

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC2=C(C=C1)OCC(=O)N2CC3=CC=C(O3)C(=O)NCC[NH+](C)C

Isomeric SMILES

CC(=O)C1=CC2=C(C=C1)OCC(=O)N2CC3=CC=C(O3)C(=O)NCC[NH+](C)C

InChI

InChI=1S/C20H23N3O5/c1-13(24)14-4-6-17-16(10-14)23(19(25)12-27-17)11-15-5-7-18(28-15)20(26)21-8-9-22(2)3/h4-7,10H,8-9,11-12H2,1-3H3,(H,21,26)/p+1