4-[[2-(diethylazaniumyl)ethyl-methyl-azaniumyl]methyl]-2-methoxy-6-nitro-phenolate

Systemtic Name: 4-[[2-(diethylazaniumyl)ethyl-methyl-azaniumyl]methyl]-2-methoxy-6-nitro-phenolate Openeye Name: 4-[[2-(diethylammonio)ethyl-methyl-ammonio]methyl]-2-methoxy-6-nitro-phenolate CAS Name: 4-[[2-(diethylammonio)ethyl-methylammonio]methyl]-2-methoxy-6-nitrophenolate IUPAC Name: 4-[[2-(diethylazaniumyl)ethyl-methylazaniumyl]methyl]-2-methoxy-6-nitrophenolate Traditional Name: 4-[[2-(diethylammonio)ethyl-methyl-ammonio]methyl]-2-methoxy-6-nitro-phenolate Formula: C15H26N3O4+ MolecularWeight: 312.38464

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CC[NH+](C)CC1=CC(=C(C(=C1)OC)[O-])[N+](=O)[O-]

Isomeric SMILES

CC[NH+](CC)CC[NH+](C)CC1=CC(=C(C(=C1)OC)[O-])[N+](=O)[O-]

InChI

InChI=1S/C15H25N3O4/c1-5-17(6-2)8-7-16(3)11-12-9-13(18(20)21)15(19)14(10-12)22-4/h9-10,19H,5-8,11H2,1-4H3/p+1