2-(4-chloranyl-3-oxidanyl-phenyl)ethyl-[3-(4-hydroxyphenyl)propyl]-propyl-azanium

Systemtic Name: 2-(4-chloranyl-3-oxidanyl-phenyl)ethyl-[3-(4-hydroxyphenyl)propyl]-propyl-azanium Openeye Name: 2-(4-chloro-3-hydroxy-phenyl)ethyl-[3-(4-hydroxyphenyl)propyl]-propyl-ammonium CAS Name: 2-(4-chloro-3-hydroxyphenyl)ethyl-[3-(4-hydroxyphenyl)propyl]-propylammonium IUPAC Name: 2-(4-chloro-3-hydroxyphenyl)ethyl-[3-(4-hydroxyphenyl)propyl]-propylazanium Traditional Name: 2-(4-chloro-3-hydroxy-phenyl)ethyl-[3-(4-hydroxyphenyl)propyl]-propyl-ammonium Formula: C20H27ClNO2+ MolecularWeight: 348.88688

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+](CCCC1=CC=C(C=C1)O)CCC2=CC(=C(C=C2)Cl)O

Isomeric SMILES

CCC[NH+](CCCC1=CC=C(C=C1)O)CCC2=CC(=C(C=C2)Cl)O

InChI

InChI=1S/C20H26ClNO2/c1-2-12-22(13-3-4-16-5-8-18(23)9-6-16)14-11-17-7-10-19(21)20(24)15-17/h5-10,15,23-24H,2-4,11-14H2,1H3/p+1