trimethyl-[11-[(2E)-2-[(5-nitrofuran-2-yl)methylidene]hydrazinyl]-11-oxidanylidene-undecyl]azanium bromide

Systemtic Name: trimethyl-[11-[(2E)-2-[(5-nitrofuran-2-yl)methylidene]hydrazinyl]-11-oxidanylidene-undecyl]azanium bromide Openeye Name: trimethyl-[11-[(2E)-2-[(5-nitro-2-furyl)methylene]hydrazino]-11-oxo-undecyl]ammonium bromide CAS Name: trimethyl-[11-[(2E)-2-[(5-nitro-2-furanyl)methylidene]hydrazinyl]-11-oxoundecyl]ammonium bromide IUPAC Name: trimethyl-[11-[(2E)-2-[(5-nitrofuran-2-yl)methylidene]hydrazinyl]-11-oxoundecyl]azanium bromide Traditional Name: [11-keto-11-[(N'E)-N'-[(5-nitro-2-furyl)methylene]hydrazino]undecyl]-trimethyl-ammonium bromide Formula: C19H33BrN4O4 MolecularWeight: 461.39372

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)CCCCCCCCCCC(=O)NN=CC1=CC=C(O1)[N+](=O)[O-].[Br-]

Isomeric SMILES

C[N+](C)(C)CCCCCCCCCCC(=O)N/N=C/C1=CC=C(O1)[N+](=O)[O-].[Br-]

InChI

InChI=1S/C19H32N4O4.BrH/c1-23(2,3)15-11-9-7-5-4-6-8-10-12-18(24)21-20-16-17-13-14-19(27-17)22(25)26;/h13-14,16H,4-12,15H2,1-3H3;1H/b20-16+;