methyl 2-ethanoyl-7-oxidanyl-8-propyl-3,4-dihydrochromene-2-carboxylate

Systemtic Name: methyl 2-ethanoyl-7-oxidanyl-8-propyl-3,4-dihydrochromene-2-carboxylate Openeye Name: methyl 2-acetyl-7-hydroxy-8-propyl-chromane-2-carboxylate CAS Name: 2-acetyl-7-hydroxy-8-propyl-3,4-dihydro-2H-1-benzopyran-2-carboxylic acid methyl ester IUPAC Name: methyl 2-acetyl-7-hydroxy-8-propyl-3,4-dihydrochromene-2-carboxylate Traditional Name: 2-acetyl-7-hydroxy-8-propyl-chroman-2-carboxylic acid methyl ester Formula: C16H20O5 MolecularWeight: 292.327

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC2=C1OC(CC2)(C(=O)C)C(=O)OC)O

Isomeric SMILES

CCCC1=C(C=CC2=C1OC(CC2)(C(=O)C)C(=O)OC)O

InChI

InChI=1S/C16H20O5/c1-4-5-12-13(18)7-6-11-8-9-16(10(2)17,15(19)20-3)21-14(11)12/h6-7,18H,4-5,8-9H2,1-3H3