2-[9-(carboxymethyl)xanthen-9-yl]ethanoic acid

Systemtic Name: 2-[9-(carboxymethyl)xanthen-9-yl]ethanoic acid Openeye Name: 2-[9-(carboxymethyl)xanthen-9-yl]acetic acid CAS Name: 2-[9-(carboxymethyl)-9-xanthenyl]acetic acid IUPAC Name: 2-[9-(carboxymethyl)xanthen-9-yl]acetic acid Traditional Name: 2-[9-(carboxymethyl)xanthen-9-yl]acetic acid Formula: C17H14O5 MolecularWeight: 298.29006

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(C3=CC=CC=C3O2)(CC(=O)O)CC(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(C3=CC=CC=C3O2)(CC(=O)O)CC(=O)O

InChI

InChI=1S/C17H14O5/c18-15(19)9-17(10-16(20)21)11-5-1-3-7-13(11)22-14-8-4-2-6-12(14)17/h1-8H,9-10H2,(H,18,19)(H,20,21)