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2-[4-(7-cyclopentylcarbonylcyclopenta[d][1,2]oxazin-4-yl)phenoxy]propanedioic acid

2-[4-(7-cyclopentylcarbonylcyclopenta[d][1,2]oxazin-4-yl)phenoxy]propanedioic acid

Systemtic Name:2-[4-(7-cyclopentylcarbonylcyclopenta[d][1,2]oxazin-4-yl)phenoxy]propanedioic acid
Openeye Name:2-[4-[7-(cyclopentanecarbonyl)cyclopenta[d]oxazin-4-yl]phenoxy]propanedioic acid
CAS Name:2-[4-[7-[cyclopentyl(oxo)methyl]-4-cyclopenta[d]oxazinyl]phenoxy]propanedioic acid
IUPAC Name:2-[4-[7-(cyclopentanecarbonyl)cyclopenta[d]oxazin-4-yl]phenoxy]propanedioic acid
Traditional Name:2-[4-[7-(cyclopentanecarbonyl)cyclopenta[d]oxazin-4-yl]phenoxy]malonic acid
Formula: C22H19NO7
MolecularWeight: 409.38876
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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)C(=O)C2=CC=C3C2=CON=C3C4=CC=C(C=C4)OC(C(=O)O)C(=O)O


Isomeric SMILES

C1CCC(C1)C(=O)C2=CC=C3C2=CON=C3C4=CC=C(C=C4)OC(C(=O)O)C(=O)O


InChI

InChI=1S/C22H19NO7/c24-19(13-3-1-2-4-13)16-10-9-15-17(16)11-29-23-18(15)12-5-7-14(8-6-12)30-20(21(25)26)22(27)28/h5-11,13,20H,1-4H2,(H,25,26)(H,27,28)


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