2-(2-azanyl-5-chloranyl-phenyl)oct-3-yn-2-ol

Systemtic Name: 2-(2-azanyl-5-chloranyl-phenyl)oct-3-yn-2-ol Openeye Name: 2-(2-amino-5-chloro-phenyl)oct-3-yn-2-ol CAS Name: 2-(2-amino-5-chlorophenyl)-3-octyn-2-ol IUPAC Name: 2-(2-amino-5-chlorophenyl)oct-3-yn-2-ol Traditional Name: 2-(2-amino-5-chloro-phenyl)oct-3-yn-2-ol Formula: C14H18ClNO MolecularWeight: 251.75182

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC#CC(C)(C1=C(C=CC(=C1)Cl)N)O

Isomeric SMILES

CCCCC#CC(C)(C1=C(C=CC(=C1)Cl)N)O

InChI

InChI=1S/C14H18ClNO/c1-3-4-5-6-9-14(2,17)12-10-11(15)7-8-13(12)16/h7-8,10,17H,3-5,16H2,1-2H3