dibutyl-[3-[(3-chloranyl-4-ethoxy-5-methoxy-phenyl)methylazaniumyl]propyl]azanium

Systemtic Name: dibutyl-[3-[(3-chloranyl-4-ethoxy-5-methoxy-phenyl)methylazaniumyl]propyl]azanium Openeye Name: dibutyl-[3-[(3-chloro-4-ethoxy-5-methoxy-phenyl)methylammonio]propyl]ammonium CAS Name: dibutyl-[3-[(3-chloro-4-ethoxy-5-methoxyphenyl)methylammonio]propyl]ammonium IUPAC Name: dibutyl-[3-[(3-chloro-4-ethoxy-5-methoxyphenyl)methylazaniumyl]propyl]azanium Traditional Name: dibutyl-[3-[(3-chloro-4-ethoxy-5-methoxy-benzyl)ammonio]propyl]ammonium Formula: C21H39ClN2O2+2 MolecularWeight: 386.99956

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[NH+](CCCC)CCC[NH2+]CC1=CC(=C(C(=C1)Cl)OCC)OC

Isomeric SMILES

CCCC[NH+](CCCC)CCC[NH2+]CC1=CC(=C(C(=C1)Cl)OCC)OC

InChI

InChI=1S/C21H37ClN2O2/c1-5-8-12-24(13-9-6-2)14-10-11-23-17-18-15-19(22)21(26-7-3)20(16-18)25-4/h15-16,23H,5-14,17H2,1-4H3/p+2