methyl 2-ethyl-7-oxidanyl-3,4-dihydrochromene-2-carboxylate

Systemtic Name: methyl 2-ethyl-7-oxidanyl-3,4-dihydrochromene-2-carboxylate Openeye Name: methyl 2-ethyl-7-hydroxy-chromane-2-carboxylate CAS Name: 2-ethyl-7-hydroxy-3,4-dihydro-2H-1-benzopyran-2-carboxylic acid methyl ester IUPAC Name: methyl 2-ethyl-7-hydroxy-3,4-dihydrochromene-2-carboxylate Traditional Name: 2-ethyl-7-hydroxy-chroman-2-carboxylic acid methyl ester Formula: C13H16O4 MolecularWeight: 236.26374

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(CCC2=C(O1)C=C(C=C2)O)C(=O)OC

Isomeric SMILES

CCC1(CCC2=C(O1)C=C(C=C2)O)C(=O)OC

InChI

InChI=1S/C13H16O4/c1-3-13(12(15)16-2)7-6-9-4-5-10(14)8-11(9)17-13/h4-5,8,14H,3,6-7H2,1-2H3