azanium 2-chloranyl-3-[4-(2-methyl-2-phenyl-propoxy)phenyl]propanoate

Systemtic Name: azanium 2-chloranyl-3-[4-(2-methyl-2-phenyl-propoxy)phenyl]propanoate Openeye Name: ammonium 2-chloro-3-[4-(2-methyl-2-phenyl-propoxy)phenyl]propanoate CAS Name: ammonium 2-chloro-3-[4-(2-methyl-2-phenylpropoxy)phenyl]propanoate IUPAC Name: azanium 2-chloro-3-[4-(2-methyl-2-phenylpropoxy)phenyl]propanoate Traditional Name: ammonium 2-chloro-3-(4-neophyloxyphenyl)propionate Formula: C19H24ClNO3 MolecularWeight: 349.85176

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(COC1=CC=C(C=C1)CC(C(=O)[O-])Cl)C2=CC=CC=C2.[NH4+]

Isomeric SMILES

CC(C)(COC1=CC=C(C=C1)CC(C(=O)[O-])Cl)C2=CC=CC=C2.[NH4+]

InChI

InChI=1S/C19H21ClO3.H3N/c1-19(2,15-6-4-3-5-7-15)13-23-16-10-8-14(9-11-16)12-17(20)18(21)22;/h3-11,17H,12-13H2,1-2H3,(H,21,22);1H3