[2-heptan-3-yl-1,3-bis(oxidanylidene)inden-2-yl] 2-oxidanylethanoate

Systemtic Name: [2-heptan-3-yl-1,3-bis(oxidanylidene)inden-2-yl] 2-oxidanylethanoate Openeye Name: [2-(1-ethylpentyl)-1,3-dioxo-indan-2-yl] 2-hydroxyacetate CAS Name: 2-hydroxyacetic acid (2-heptan-3-yl-1,3-dioxo-2-indenyl) ester IUPAC Name: (2-heptan-3-yl-1,3-dioxoinden-2-yl) 2-hydroxyacetate Traditional Name: 2-hydroxyacetic acid [2-(1-ethylpentyl)-1,3-diketo-indan-2-yl] ester Formula: C18H22O5 MolecularWeight: 318.36428

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)C1(C(=O)C2=CC=CC=C2C1=O)OC(=O)CO

Isomeric SMILES

CCCCC(CC)C1(C(=O)C2=CC=CC=C2C1=O)OC(=O)CO

InChI

InChI=1S/C18H22O5/c1-3-5-8-12(4-2)18(23-15(20)11-19)16(21)13-9-6-7-10-14(13)17(18)22/h6-7,9-10,12,19H,3-5,8,11H2,1-2H3