3-(7-ethoxycarbonyl-3-oxidanyl-9-oxidanylidene-xanthen-4-yl)propanoic acid

Systemtic Name: 3-(7-ethoxycarbonyl-3-oxidanyl-9-oxidanylidene-xanthen-4-yl)propanoic acid Openeye Name: 3-(7-ethoxycarbonyl-3-hydroxy-9-oxo-xanthen-4-yl)propanoic acid CAS Name: 3-(7-ethoxycarbonyl-3-hydroxy-9-oxo-4-xanthenyl)propanoic acid IUPAC Name: 3-(7-ethoxycarbonyl-3-hydroxy-9-oxoxanthen-4-yl)propanoic acid Traditional Name: 3-(7-carbethoxy-3-hydroxy-9-keto-xanthen-4-yl)propionic acid Formula: C19H16O7 MolecularWeight: 356.32614

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=C(C=C1)OC3=C(C2=O)C=CC(=C3CCC(=O)O)O

Isomeric SMILES

CCOC(=O)C1=CC2=C(C=C1)OC3=C(C2=O)C=CC(=C3CCC(=O)O)O

InChI

InChI=1S/C19H16O7/c1-2-25-19(24)10-3-7-15-13(9-10)17(23)12-4-6-14(20)11(18(12)26-15)5-8-16(21)22/h3-4,6-7,9,20H,2,5,8H2,1H3,(H,21,22)