4-(2-chloranyl-5-nitro-phenyl)-2-methyl-but-3-yn-2-ol

Systemtic Name: 4-(2-chloranyl-5-nitro-phenyl)-2-methyl-but-3-yn-2-ol Openeye Name: 4-(2-chloro-5-nitro-phenyl)-2-methyl-but-3-yn-2-ol CAS Name: 4-(2-chloro-5-nitrophenyl)-2-methyl-3-butyn-2-ol IUPAC Name: 4-(2-chloro-5-nitrophenyl)-2-methylbut-3-yn-2-ol Traditional Name: 4-(2-chloro-5-nitro-phenyl)-2-methyl-but-3-yn-2-ol Formula: C11H10ClNO3 MolecularWeight: 239.655

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C#CC1=C(C=CC(=C1)[N+](=O)[O-])Cl)O

Isomeric SMILES

CC(C)(C#CC1=C(C=CC(=C1)[N+](=O)[O-])Cl)O

InChI

InChI=1S/C11H10ClNO3/c1-11(2,14)6-5-8-7-9(13(15)16)3-4-10(8)12/h3-4,7,14H,1-2H3