4-oxidanylidenepent-2-ynyl 2-(4-ethoxyphenyl)-3-methyl-butanoate

Systemtic Name: 4-oxidanylidenepent-2-ynyl 2-(4-ethoxyphenyl)-3-methyl-butanoate Openeye Name: 4-oxopent-2-ynyl 2-(4-ethoxyphenyl)-3-methyl-butanoate CAS Name: 2-(4-ethoxyphenyl)-3-methylbutanoic acid 4-oxopent-2-ynyl ester IUPAC Name: 4-oxopent-2-ynyl 2-(4-ethoxyphenyl)-3-methylbutanoate Traditional Name: 3-methyl-2-p-phenetyl-butyric acid 4-ketopent-2-ynyl ester Formula: C18H22O4 MolecularWeight: 302.36488

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H22O4/c1-5-21-16-10-8-15(9-11-16)17(13(2)3)18(20)22-12-6-7-14(4)19/h8-11,13,17H,5,12H2,1-4H3