ethyl 5-(4-butylphenyl)-4-oxidanylidene-pyran-2-carboxylate

Systemtic Name: ethyl 5-(4-butylphenyl)-4-oxidanylidene-pyran-2-carboxylate Openeye Name: ethyl 5-(4-butylphenyl)-4-oxo-pyran-2-carboxylate CAS Name: 5-(4-butylphenyl)-4-oxo-2-pyrancarboxylic acid ethyl ester IUPAC Name: ethyl 5-(4-butylphenyl)-4-oxopyran-2-carboxylate Traditional Name: 5-(4-butylphenyl)-4-keto-pyran-2-carboxylic acid ethyl ester Formula: C18H20O4 MolecularWeight: 300.349

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C2=COC(=CC2=O)C(=O)OCC

Isomeric SMILES

CCCCC1=CC=C(C=C1)C2=COC(=CC2=O)C(=O)OCC

InChI

InChI=1S/C18H20O4/c1-3-5-6-13-7-9-14(10-8-13)15-12-22-17(11-16(15)19)18(20)21-4-2/h7-12H,3-6H2,1-2H3