methyl 2-(5-oxidanyldec-9-en-1-ynyl)benzoate

Systemtic Name: methyl 2-(5-oxidanyldec-9-en-1-ynyl)benzoate Openeye Name: methyl 2-(5-hydroxydec-9-en-1-ynyl)benzoate CAS Name: 2-(5-hydroxydec-9-en-1-ynyl)benzoic acid methyl ester IUPAC Name: methyl 2-(5-hydroxydec-9-en-1-ynyl)benzoate Traditional Name: 2-(5-hydroxydec-9-en-1-ynyl)benzoic acid methyl ester Formula: C18H22O3 MolecularWeight: 286.36548

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1C#CCCC(CCCC=C)O

Isomeric SMILES

COC(=O)C1=CC=CC=C1C#CCCC(CCCC=C)O

InChI

InChI=1S/C18H22O3/c1-3-4-5-12-16(19)13-8-6-10-15-11-7-9-14-17(15)18(20)21-2/h3,7,9,11,14,16,19H,1,4-5,8,12-13H2,2H3