methyl 2-[4-(4-oxidanylbut-1-ynyl)phenyl]butanoate

Systemtic Name: methyl 2-[4-(4-oxidanylbut-1-ynyl)phenyl]butanoate Openeye Name: methyl 2-[4-(4-hydroxybut-1-ynyl)phenyl]butanoate CAS Name: 2-[4-(4-hydroxybut-1-ynyl)phenyl]butanoic acid methyl ester IUPAC Name: methyl 2-[4-(4-hydroxybut-1-ynyl)phenyl]butanoate Traditional Name: 2-[4-(4-hydroxybut-1-ynyl)phenyl]butyric acid methyl ester Formula: C15H18O3 MolecularWeight: 246.30162

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=C(C=C1)C#CCCO)C(=O)OC

Isomeric SMILES

CCC(C1=CC=C(C=C1)C#CCCO)C(=O)OC

InChI

InChI=1S/C15H18O3/c1-3-14(15(17)18-2)13-9-7-12(8-10-13)6-4-5-11-16/h7-10,14,16H,3,5,11H2,1-2H3