3-[5-(3-acetyloxyprop-1-ynyl)-2,4-dimethyl-phenyl]prop-2-ynyl ethanoate

Systemtic Name: 3-[5-(3-acetyloxyprop-1-ynyl)-2,4-dimethyl-phenyl]prop-2-ynyl ethanoate Openeye Name: 3-[5-(3-acetoxyprop-1-ynyl)-2,4-dimethyl-phenyl]prop-2-ynyl acetate CAS Name: acetic acid 3-[5-(3-acetyloxyprop-1-ynyl)-2,4-dimethylphenyl]prop-2-ynyl ester IUPAC Name: 3-[5-(3-acetyloxyprop-1-ynyl)-2,4-dimethylphenyl]prop-2-ynyl acetate Traditional Name: acetic acid 3-[5-(3-acetoxyprop-1-ynyl)-2,4-dimethyl-phenyl]prop-2-ynyl ester Formula: C18H18O4 MolecularWeight: 298.33312

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C#CCOC(=O)C)C#CCOC(=O)C)C

Isomeric SMILES

CC1=CC(=C(C=C1C#CCOC(=O)C)C#CCOC(=O)C)C

InChI

InChI=1S/C18H18O4/c1-13-11-14(2)18(8-6-10-22-16(4)20)12-17(13)7-5-9-21-15(3)19/h11-12H,9-10H2,1-4H3