4-(4-bromanyl-3-methyl-phenyl)-2-methyl-but-3-yn-2-ol

Systemtic Name: 4-(4-bromanyl-3-methyl-phenyl)-2-methyl-but-3-yn-2-ol Openeye Name: 4-(4-bromo-3-methyl-phenyl)-2-methyl-but-3-yn-2-ol CAS Name: 4-(4-bromo-3-methylphenyl)-2-methyl-3-butyn-2-ol IUPAC Name: 4-(4-bromo-3-methylphenyl)-2-methylbut-3-yn-2-ol Traditional Name: 4-(4-bromo-3-methyl-phenyl)-2-methyl-but-3-yn-2-ol Formula: C12H13BrO MolecularWeight: 253.13502

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C#CC(C)(C)O)Br

Isomeric SMILES

CC1=C(C=CC(=C1)C#CC(C)(C)O)Br

InChI

InChI=1S/C12H13BrO/c1-9-8-10(4-5-11(9)13)6-7-12(2,3)14/h4-5,8,14H,1-3H3