[5-oxidanyl-2-(phenylcarbonyl)phenyl] 4-[2-ethylhexyl(methyl)amino]benzoate

Systemtic Name: [5-oxidanyl-2-(phenylcarbonyl)phenyl] 4-[2-ethylhexyl(methyl)amino]benzoate Openeye Name: (2-benzoyl-5-hydroxy-phenyl) 4-[2-ethylhexyl(methyl)amino]benzoate CAS Name: 4-[2-ethylhexyl(methyl)amino]benzoic acid (2-benzoyl-5-hydroxyphenyl) ester IUPAC Name: (2-benzoyl-5-hydroxyphenyl) 4-[2-ethylhexyl(methyl)amino]benzoate Traditional Name: 4-[2-ethylhexyl(methyl)amino]benzoic acid (2-benzoyl-5-hydroxy-phenyl) ester Formula: C29H33NO4 MolecularWeight: 459.57662

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)CN(C)C1=CC=C(C=C1)C(=O)OC2=C(C=CC(=C2)O)C(=O)C3=CC=CC=C3

Isomeric SMILES

CCCCC(CC)CN(C)C1=CC=C(C=C1)C(=O)OC2=C(C=CC(=C2)O)C(=O)C3=CC=CC=C3

InChI

InChI=1S/C29H33NO4/c1-4-6-10-21(5-2)20-30(3)24-15-13-23(14-16-24)29(33)34-27-19-25(31)17-18-26(27)28(32)22-11-8-7-9-12-22/h7-9,11-19,21,31H,4-6,10,20H2,1-3H3