4-[4-(1,3-benzoxazol-2-yl)phenyl]-1,3,4-tris(oxidanyl)butan-2-one

Systemtic Name: 4-[4-(1,3-benzoxazol-2-yl)phenyl]-1,3,4-tris(oxidanyl)butan-2-one Openeye Name: 4-[4-(1,3-benzoxazol-2-yl)phenyl]-1,3,4-trihydroxy-butan-2-one CAS Name: 4-[4-(1,3-benzoxazol-2-yl)phenyl]-1,3,4-trihydroxy-2-butanone IUPAC Name: 4-[4-(1,3-benzoxazol-2-yl)phenyl]-1,3,4-trihydroxybutan-2-one Traditional Name: 4-[4-(1,3-benzoxazol-2-yl)phenyl]-1,3,4-trihydroxy-butan-2-one Formula: C17H15NO5 MolecularWeight: 313.3047

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(O2)C3=CC=C(C=C3)C(C(C(=O)CO)O)O

Isomeric SMILES

C1=CC=C2C(=C1)N=C(O2)C3=CC=C(C=C3)C(C(C(=O)CO)O)O

InChI

InChI=1S/C17H15NO5/c19-9-13(20)16(22)15(21)10-5-7-11(8-6-10)17-18-12-3-1-2-4-14(12)23-17/h1-8,15-16,19,21-22H,9H2