(4-methoxy-4-oxidanylidene-but-2-ynyl) 2-(4-ethoxyphenyl)-3-methyl-butanoate

Systemtic Name: (4-methoxy-4-oxidanylidene-but-2-ynyl) 2-(4-ethoxyphenyl)-3-methyl-butanoate Openeye Name: (4-methoxy-4-oxo-but-2-ynyl) 2-(4-ethoxyphenyl)-3-methyl-butanoate CAS Name: 2-(4-ethoxyphenyl)-3-methylbutanoic acid (4-methoxy-4-oxobut-2-ynyl) ester IUPAC Name: (4-methoxy-4-oxobut-2-ynyl) 2-(4-ethoxyphenyl)-3-methylbutanoate Traditional Name: 3-methyl-2-p-phenetyl-butyric acid (4-keto-4-methoxy-but-2-ynyl) ester Formula: C18H22O5 MolecularWeight: 318.36428

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(C(C)C)C(=O)OCC#CC(=O)OC

Isomeric SMILES

CCOC1=CC=C(C=C1)C(C(C)C)C(=O)OCC#CC(=O)OC

InChI

InChI=1S/C18H22O5/c1-5-22-15-10-8-14(9-11-15)17(13(2)3)18(20)23-12-6-7-16(19)21-4/h8-11,13,17H,5,12H2,1-4H3