2-[(4-chloranylphenoxy)methyl]-3,3-dimethyl-butane-1,2-diol

Systemtic Name: 2-[(4-chloranylphenoxy)methyl]-3,3-dimethyl-butane-1,2-diol Openeye Name: 2-[(4-chlorophenoxy)methyl]-3,3-dimethyl-butane-1,2-diol CAS Name: 2-[(4-chlorophenoxy)methyl]-3,3-dimethylbutane-1,2-diol IUPAC Name: 2-[(4-chlorophenoxy)methyl]-3,3-dimethylbutane-1,2-diol Traditional Name: 2-[(4-chlorophenoxy)methyl]-3,3-dimethyl-butane-1,2-diol Formula: C13H19ClO3 MolecularWeight: 258.74116

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(CO)(COC1=CC=C(C=C1)Cl)O

Isomeric SMILES

CC(C)(C)C(CO)(COC1=CC=C(C=C1)Cl)O

InChI

InChI=1S/C13H19ClO3/c1-12(2,3)13(16,8-15)9-17-11-6-4-10(14)5-7-11/h4-7,15-16H,8-9H2,1-3H3