[5-[3-[(diethylazaniumyl)methyl]-4-oxidanyl-5-prop-2-enyl-phenyl]-2-oxidanyl-3-prop-2-enyl-phenyl]methyl-diethyl-azanium dichloride

Systemtic Name: [5-[3-[(diethylazaniumyl)methyl]-4-oxidanyl-5-prop-2-enyl-phenyl]-2-oxidanyl-3-prop-2-enyl-phenyl]methyl-diethyl-azanium dichloride Openeye Name: [3-allyl-5-[3-allyl-5-[(diethylammonio)methyl]-4-hydroxy-phenyl]-2-hydroxy-phenyl]methyl-diethyl-ammonium dichloride CAS Name: [5-[3-[(diethylammonio)methyl]-4-hydroxy-5-prop-2-enylphenyl]-2-hydroxy-3-prop-2-enylphenyl]methyl-diethylammonium dichloride IUPAC Name: [5-[3-[(diethylazaniumyl)methyl]-4-hydroxy-5-prop-2-enylphenyl]-2-hydroxy-3-prop-2-enylphenyl]methyl-diethylazanium dichloride Traditional Name: [3-allyl-5-[3-allyl-5-[(diethylammonio)methyl]-4-hydroxy-phenyl]-2-hydroxy-benzyl]-diethyl-ammonium dichloride Formula: C28H42Cl2N2O2 MolecularWeight: 509.55128

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CC1=CC(=CC(=C1O)CC=C)C2=CC(=C(C(=C2)C[NH+](CC)CC)O)CC=C.[Cl-].[Cl-]

Isomeric SMILES

CC[NH+](CC)CC1=CC(=CC(=C1O)CC=C)C2=CC(=C(C(=C2)C[NH+](CC)CC)O)CC=C.[Cl-].[Cl-]

InChI

InChI=1S/C28H40N2O2.2ClH/c1-7-13-21-15-23(17-25(27(21)31)19-29(9-3)10-4)24-16-22(14-8-2)28(32)26(18-24)20-30(11-5)12-6;;/h7-8,15-18,31-32H,1-2,9-14,19-20H2,3-6H3;2*1H