(6-oxidanylidenebenzo[c]chromen-3-yl) 2-ethylhexanoate

Systemtic Name: (6-oxidanylidenebenzo[c]chromen-3-yl) 2-ethylhexanoate Openeye Name: (6-oxobenzo[c]chromen-3-yl) 2-ethylhexanoate CAS Name: 2-ethylhexanoic acid (6-oxo-3-benzo[c][1]benzopyranyl) ester IUPAC Name: (6-oxobenzo[c]chromen-3-yl) 2-ethylhexanoate Traditional Name: 2-ethylhexanoic acid (6-ketobenzo[c]chromen-3-yl) ester Formula: C21H22O4 MolecularWeight: 338.39698

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)C(=O)OC1=CC2=C(C=C1)C3=CC=CC=C3C(=O)O2

Isomeric SMILES

CCCCC(CC)C(=O)OC1=CC2=C(C=C1)C3=CC=CC=C3C(=O)O2

InChI

InChI=1S/C21H22O4/c1-3-5-8-14(4-2)20(22)24-15-11-12-17-16-9-6-7-10-18(16)21(23)25-19(17)13-15/h6-7,9-14H,3-5,8H2,1-2H3