4,4-dihexyl-6-(4-oxidanylbutoxy)-1H-3,1-benzoxazin-2-one

Systemtic Name: 4,4-dihexyl-6-(4-oxidanylbutoxy)-1H-3,1-benzoxazin-2-one Openeye Name: 4,4-dihexyl-6-(4-hydroxybutoxy)-1H-3,1-benzoxazin-2-one CAS Name: 4,4-dihexyl-6-(4-hydroxybutoxy)-1H-3,1-benzoxazin-2-one IUPAC Name: 4,4-dihexyl-6-(4-hydroxybutoxy)-1H-3,1-benzoxazin-2-one Traditional Name: 4,4-dihexyl-6-(4-hydroxybutoxy)-1H-3,1-benzoxazin-2-one Formula: C24H39NO4 MolecularWeight: 405.57076

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1(C2=C(C=CC(=C2)OCCCCO)NC(=O)O1)CCCCCC

Isomeric SMILES

CCCCCCC1(C2=C(C=CC(=C2)OCCCCO)NC(=O)O1)CCCCCC

InChI

InChI=1S/C24H39NO4/c1-3-5-7-9-15-24(16-10-8-6-4-2)21-19-20(28-18-12-11-17-26)13-14-22(21)25-23(27)29-24/h13-14,19,26H,3-12,15-18H2,1-2H3,(H,25,27)