methyl 3-[2-methyl-7,8-bis(oxidanyl)-3,4-dihydrochromen-2-yl]propanoate

Systemtic Name: methyl 3-[2-methyl-7,8-bis(oxidanyl)-3,4-dihydrochromen-2-yl]propanoate Openeye Name: methyl 3-(7,8-dihydroxy-2-methyl-chroman-2-yl)propanoate CAS Name: 3-(7,8-dihydroxy-2-methyl-3,4-dihydro-2H-1-benzopyran-2-yl)propanoic acid methyl ester IUPAC Name: methyl 3-(7,8-dihydroxy-2-methyl-3,4-dihydrochromen-2-yl)propanoate Traditional Name: 3-(7,8-dihydroxy-2-methyl-chroman-2-yl)propionic acid methyl ester Formula: C14H18O5 MolecularWeight: 266.28972

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCC2=C(O1)C(=C(C=C2)O)O)CCC(=O)OC

Isomeric SMILES

CC1(CCC2=C(O1)C(=C(C=C2)O)O)CCC(=O)OC

InChI

InChI=1S/C14H18O5/c1-14(8-6-11(16)18-2)7-5-9-3-4-10(15)12(17)13(9)19-14/h3-4,15,17H,5-8H2,1-2H3