3-[2-(3-oxidanidyl-3-oxidanylidene-propyl)-7-oxidanyl-8-propyl-3,4-dihydrochromen-2-yl]propanoate

Systemtic Name: 3-[2-(3-oxidanidyl-3-oxidanylidene-propyl)-7-oxidanyl-8-propyl-3,4-dihydrochromen-2-yl]propanoate Openeye Name: 3-[7-hydroxy-2-(3-oxido-3-oxo-propyl)-8-propyl-chroman-2-yl]propanoate CAS Name: 3-[7-hydroxy-2-(3-oxido-3-oxopropyl)-8-propyl-3,4-dihydro-2H-1-benzopyran-2-yl]propanoate IUPAC Name: 3-[7-hydroxy-2-(3-oxido-3-oxopropyl)-8-propyl-3,4-dihydrochromen-2-yl]propanoate Traditional Name: 3-[7-hydroxy-2-(3-keto-3-oxido-propyl)-8-propyl-chroman-2-yl]propionate Formula: C18H22O6-2 MolecularWeight: 334.36368

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC2=C1OC(CC2)(CCC(=O)[O-])CCC(=O)[O-])O

Isomeric SMILES

CCCC1=C(C=CC2=C1OC(CC2)(CCC(=O)[O-])CCC(=O)[O-])O

InChI

InChI=1S/C18H24O6/c1-2-3-13-14(19)5-4-12-6-9-18(24-17(12)13,10-7-15(20)21)11-8-16(22)23/h4-5,19H,2-3,6-11H2,1H3,(H,20,21)(H,22,23)/p-2