3-[(3-bromanyl-5-methoxy-4-oxidanyl-phenyl)methylazaniumyl]propyl-diethyl-azanium

Systemtic Name: 3-[(3-bromanyl-5-methoxy-4-oxidanyl-phenyl)methylazaniumyl]propyl-diethyl-azanium Openeye Name: 3-[(3-bromo-4-hydroxy-5-methoxy-phenyl)methylammonio]propyl-diethyl-ammonium CAS Name: 3-[(3-bromo-4-hydroxy-5-methoxyphenyl)methylammonio]propyl-diethylammonium IUPAC Name: 3-[(3-bromo-4-hydroxy-5-methoxyphenyl)methylazaniumyl]propyl-diethylazanium Traditional Name: 3-[(3-bromo-4-hydroxy-5-methoxy-benzyl)ammonio]propyl-diethyl-ammonium Formula: C15H27BrN2O2+2 MolecularWeight: 347.29108

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H25BrN2O2/c1-4-18(5-2)8-6-7-17-11-12-9-13(16)15(19)14(10-12)20-3/h9-10,17,19H,4-8,11H2,1-3H3/p+2