3-(5-ethoxycarbonyl-3-oxidanyl-9-oxidanylidene-xanthen-2-yl)propanoic acid

Systemtic Name: 3-(5-ethoxycarbonyl-3-oxidanyl-9-oxidanylidene-xanthen-2-yl)propanoic acid Openeye Name: 3-(5-ethoxycarbonyl-3-hydroxy-9-oxo-xanthen-2-yl)propanoic acid CAS Name: 3-(5-ethoxycarbonyl-3-hydroxy-9-oxo-2-xanthenyl)propanoic acid IUPAC Name: 3-(5-ethoxycarbonyl-3-hydroxy-9-oxoxanthen-2-yl)propanoic acid Traditional Name: 3-(5-carbethoxy-3-hydroxy-9-keto-xanthen-2-yl)propionic acid Formula: C19H16O7 MolecularWeight: 356.32614

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=CC2=C1OC3=CC(=C(C=C3C2=O)CCC(=O)O)O

Isomeric SMILES

CCOC(=O)C1=CC=CC2=C1OC3=CC(=C(C=C3C2=O)CCC(=O)O)O

InChI

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