4-[[3-(diethylazaniumyl)propylazaniumyl]methyl]benzoate

Systemtic Name: 4-[[3-(diethylazaniumyl)propylazaniumyl]methyl]benzoate Openeye Name: 4-[[3-(diethylammonio)propylammonio]methyl]benzoate CAS Name: 4-[[3-(diethylammonio)propylammonio]methyl]benzoate IUPAC Name: 4-[[3-(diethylazaniumyl)propylazaniumyl]methyl]benzoate Traditional Name: 4-[[3-(diethylammonio)propylammonio]methyl]benzoate Formula: C15H25N2O2+ MolecularWeight: 265.3712

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCC[NH2+]CC1=CC=C(C=C1)C(=O)[O-]

Isomeric SMILES

CC[NH+](CC)CCC[NH2+]CC1=CC=C(C=C1)C(=O)[O-]

InChI

InChI=1S/C15H24N2O2/c1-3-17(4-2)11-5-10-16-12-13-6-8-14(9-7-13)15(18)19/h6-9,16H,3-5,10-12H2,1-2H3,(H,18,19)/p+1