5-oxidanylidene-5-[2-(1-oxidanylideneisochromen-3-yl)ethoxy]pentanoic acid

Systemtic Name: 5-oxidanylidene-5-[2-(1-oxidanylideneisochromen-3-yl)ethoxy]pentanoic acid Openeye Name: 5-oxo-5-[2-(1-oxoisochromen-3-yl)ethoxy]pentanoic acid CAS Name: 5-oxo-5-[2-(1-oxo-2-benzopyran-3-yl)ethoxy]pentanoic acid IUPAC Name: 5-oxo-5-[2-(1-oxoisochromen-3-yl)ethoxy]pentanoic acid Traditional Name: 5-keto-5-[2-(1-ketoisochromen-3-yl)ethoxy]valeric acid Formula: C16H16O6 MolecularWeight: 304.29464

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(OC2=O)CCOC(=O)CCCC(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C=C(OC2=O)CCOC(=O)CCCC(=O)O

InChI

InChI=1S/C16H16O6/c17-14(18)6-3-7-15(19)21-9-8-12-10-11-4-1-2-5-13(11)16(20)22-12/h1-2,4-5,10H,3,6-9H2,(H,17,18)