[5-(3-chloranyl-4-methyl-phenyl)furan-2-yl]methyl-[2-(2-hydroxyethylazaniumyl)ethyl]azanium

Systemtic Name: [5-(3-chloranyl-4-methyl-phenyl)furan-2-yl]methyl-[2-(2-hydroxyethylazaniumyl)ethyl]azanium Openeye Name: [5-(3-chloro-4-methyl-phenyl)-2-furyl]methyl-[2-(2-hydroxyethylammonio)ethyl]ammonium CAS Name: [5-(3-chloro-4-methylphenyl)-2-furanyl]methyl-[2-(2-hydroxyethylammonio)ethyl]ammonium IUPAC Name: [5-(3-chloro-4-methylphenyl)furan-2-yl]methyl-[2-(2-hydroxyethylazaniumyl)ethyl]azanium Traditional Name: [5-(3-chloro-4-methyl-phenyl)-2-furyl]methyl-[2-(2-hydroxyethylammonio)ethyl]ammonium Formula: C16H23ClN2O2+2 MolecularWeight: 310.81902

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=CC=C(O2)C[NH2+]CC[NH2+]CCO)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)C2=CC=C(O2)C[NH2+]CC[NH2+]CCO)Cl

InChI

InChI=1S/C16H21ClN2O2/c1-12-2-3-13(10-15(12)17)16-5-4-14(21-16)11-19-7-6-18-8-9-20/h2-5,10,18-20H,6-9,11H2,1H3/p+2