3-[5-chloranyl-2-(phenylmethyl)-1,3-benzoxazol-7-yl]prop-2-yn-1-ol

Systemtic Name: 3-[5-chloranyl-2-(phenylmethyl)-1,3-benzoxazol-7-yl]prop-2-yn-1-ol Openeye Name: 3-(2-benzyl-5-chloro-1,3-benzoxazol-7-yl)prop-2-yn-1-ol CAS Name: 3-[5-chloro-2-(phenylmethyl)-1,3-benzoxazol-7-yl]-2-propyn-1-ol IUPAC Name: 3-(2-benzyl-5-chloro-1,3-benzoxazol-7-yl)prop-2-yn-1-ol Traditional Name: 3-(2-benzyl-5-chloro-1,3-benzoxazol-7-yl)prop-2-yn-1-ol Formula: C17H12ClNO2 MolecularWeight: 297.73568

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=NC3=C(O2)C(=CC(=C3)Cl)C#CCO

Isomeric SMILES

C1=CC=C(C=C1)CC2=NC3=C(O2)C(=CC(=C3)Cl)C#CCO

InChI

InChI=1S/C17H12ClNO2/c18-14-10-13(7-4-8-20)17-15(11-14)19-16(21-17)9-12-5-2-1-3-6-12/h1-3,5-6,10-11,20H,8-9H2