3-[(3-ethoxy-2-oxidanyl-phenyl)methylazaniumyl]propyl-diethyl-azanium

Systemtic Name: 3-[(3-ethoxy-2-oxidanyl-phenyl)methylazaniumyl]propyl-diethyl-azanium Openeye Name: 3-[(3-ethoxy-2-hydroxy-phenyl)methylammonio]propyl-diethyl-ammonium CAS Name: 3-[(3-ethoxy-2-hydroxyphenyl)methylammonio]propyl-diethylammonium IUPAC Name: 3-[(3-ethoxy-2-hydroxyphenyl)methylazaniumyl]propyl-diethylazanium Traditional Name: 3-[(3-ethoxy-2-hydroxy-benzyl)ammonio]propyl-diethyl-ammonium Formula: C16H30N2O2+2 MolecularWeight: 282.4216

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H28N2O2/c1-4-18(5-2)12-8-11-17-13-14-9-7-10-15(16(14)19)20-6-3/h7,9-10,17,19H,4-6,8,11-13H2,1-3H3/p+2