7-(1-ethoxy-2-methyl-propyl)-5-(2-methylpropyl)-9-oxidanylidene-xanthene-2-carboxylic acid

Systemtic Name: 7-(1-ethoxy-2-methyl-propyl)-5-(2-methylpropyl)-9-oxidanylidene-xanthene-2-carboxylic acid Openeye Name: 7-(1-ethoxy-2-methyl-propyl)-5-isobutyl-9-oxo-xanthene-2-carboxylic acid CAS Name: 7-(1-ethoxy-2-methylpropyl)-5-(2-methylpropyl)-9-oxo-2-xanthenecarboxylic acid IUPAC Name: 7-(1-ethoxy-2-methylpropyl)-5-(2-methylpropyl)-9-oxoxanthene-2-carboxylic acid Traditional Name: 7-(1-ethoxy-2-methyl-propyl)-5-isobutyl-9-keto-xanthene-2-carboxylic acid Formula: C24H28O5 MolecularWeight: 396.47612

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(C1=CC(=C2C(=C1)C(=O)C3=C(O2)C=CC(=C3)C(=O)O)CC(C)C)C(C)C

Isomeric SMILES

CCOC(C1=CC(=C2C(=C1)C(=O)C3=C(O2)C=CC(=C3)C(=O)O)CC(C)C)C(C)C

InChI

InChI=1S/C24H28O5/c1-6-28-22(14(4)5)17-10-16(9-13(2)3)23-19(12-17)21(25)18-11-15(24(26)27)7-8-20(18)29-23/h7-8,10-14,22H,6,9H2,1-5H3,(H,26,27)