ethyl (3S,4R)-2-oxidanylidene-4-propyl-3,4-dihydrochromene-3-carboxylate

Systemtic Name: ethyl (3S,4R)-2-oxidanylidene-4-propyl-3,4-dihydrochromene-3-carboxylate Openeye Name: ethyl (3S,4R)-2-oxo-4-propyl-chromane-3-carboxylate CAS Name: (3S,4R)-2-oxo-4-propyl-3,4-dihydro-2H-1-benzopyran-3-carboxylic acid ethyl ester IUPAC Name: ethyl (3S,4R)-2-oxo-4-propyl-3,4-dihydrochromene-3-carboxylate Traditional Name: (3S,4R)-2-keto-4-propyl-chroman-3-carboxylic acid ethyl ester Formula: C15H18O4 MolecularWeight: 262.30102

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1C(C(=O)OC2=CC=CC=C12)C(=O)OCC

Isomeric SMILES

CCC[C@@H]1[C@H](C(=O)OC2=CC=CC=C12)C(=O)OCC

InChI

InChI=1S/C15H18O4/c1-3-7-11-10-8-5-6-9-12(10)19-15(17)13(11)14(16)18-4-2/h5-6,8-9,11,13H,3-4,7H2,1-2H3/t11-,13-/m0/s1