dibutyl-[3-[[5-(3-chlorophenyl)furan-2-yl]methylazaniumyl]propyl]azanium

Systemtic Name: dibutyl-[3-[[5-(3-chlorophenyl)furan-2-yl]methylazaniumyl]propyl]azanium Openeye Name: dibutyl-[3-[[5-(3-chlorophenyl)-2-furyl]methylammonio]propyl]ammonium CAS Name: dibutyl-[3-[[5-(3-chlorophenyl)-2-furanyl]methylammonio]propyl]ammonium IUPAC Name: dibutyl-[3-[[5-(3-chlorophenyl)furan-2-yl]methylazaniumyl]propyl]azanium Traditional Name: dibutyl-[3-[[5-(3-chlorophenyl)-2-furyl]methylammonio]propyl]ammonium Formula: C22H35ClN2O+2 MolecularWeight: 378.9791

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[NH+](CCCC)CCC[NH2+]CC1=CC=C(O1)C2=CC(=CC=C2)Cl

Isomeric SMILES

CCCC[NH+](CCCC)CCC[NH2+]CC1=CC=C(O1)C2=CC(=CC=C2)Cl

InChI

InChI=1S/C22H33ClN2O/c1-3-5-14-25(15-6-4-2)16-8-13-24-18-21-11-12-22(26-21)19-9-7-10-20(23)17-19/h7,9-12,17,24H,3-6,8,13-16,18H2,1-2H3/p+2