2-(4-chloranyl-3,5-dimethyl-phenoxy)ethyl-[(4-hydroxyphenyl)methyl]azanium

Systemtic Name: 2-(4-chloranyl-3,5-dimethyl-phenoxy)ethyl-[(4-hydroxyphenyl)methyl]azanium Openeye Name: 2-(4-chloro-3,5-dimethyl-phenoxy)ethyl-[(4-hydroxyphenyl)methyl]ammonium CAS Name: 2-(4-chloro-3,5-dimethylphenoxy)ethyl-[(4-hydroxyphenyl)methyl]ammonium IUPAC Name: 2-(4-chloro-3,5-dimethylphenoxy)ethyl-[(4-hydroxyphenyl)methyl]azanium Traditional Name: 2-(4-chloro-3,5-dimethyl-phenoxy)ethyl-(4-hydroxybenzyl)ammonium Formula: C17H21ClNO2+ MolecularWeight: 306.80714

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1Cl)C)OCC[NH2+]CC2=CC=C(C=C2)O

Isomeric SMILES

CC1=CC(=CC(=C1Cl)C)OCC[NH2+]CC2=CC=C(C=C2)O

InChI

InChI=1S/C17H20ClNO2/c1-12-9-16(10-13(2)17(12)18)21-8-7-19-11-14-3-5-15(20)6-4-14/h3-6,9-10,19-20H,7-8,11H2,1-2H3/p+1