dibutyl-[3-[(3-methoxy-4-phenethyloxy-phenyl)methylazaniumyl]propyl]azanium

Systemtic Name: dibutyl-[3-[(3-methoxy-4-phenethyloxy-phenyl)methylazaniumyl]propyl]azanium Openeye Name: dibutyl-[3-[(3-methoxy-4-phenethyloxy-phenyl)methylammonio]propyl]ammonium CAS Name: dibutyl-[3-[(3-methoxy-4-phenethyloxyphenyl)methylammonio]propyl]ammonium IUPAC Name: dibutyl-[3-[(3-methoxy-4-phenethyloxyphenyl)methylazaniumyl]propyl]azanium Traditional Name: dibutyl-[3-[(3-methoxy-4-phenethyloxy-benzyl)ammonio]propyl]ammonium Formula: C27H44N2O2+2 MolecularWeight: 428.65046

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[NH+](CCCC)CCC[NH2+]CC1=CC(=C(C=C1)OCCC2=CC=CC=C2)OC

Isomeric SMILES

CCCC[NH+](CCCC)CCC[NH2+]CC1=CC(=C(C=C1)OCCC2=CC=CC=C2)OC

InChI

InChI=1S/C27H42N2O2/c1-4-6-18-29(19-7-5-2)20-11-17-28-23-25-14-15-26(27(22-25)30-3)31-21-16-24-12-9-8-10-13-24/h8-10,12-15,22,28H,4-7,11,16-21,23H2,1-3H3/p+2