3-methyl-5-(4-methylphenyl)-2-propan-2-yl-pent-4-ynoate

Systemtic Name: 3-methyl-5-(4-methylphenyl)-2-propan-2-yl-pent-4-ynoate Openeye Name: 2-isopropyl-3-methyl-5-(p-tolyl)pent-4-ynoate CAS Name: 3-methyl-5-(4-methylphenyl)-2-propan-2-yl-4-pentynoate IUPAC Name: 3-methyl-5-(4-methylphenyl)-2-propan-2-ylpent-4-ynoate Traditional Name: 2-isopropyl-3-methyl-5-(p-tolyl)pent-4-ynoate Formula: C16H19O2- MolecularWeight: 243.32086

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C#CC(C)C(C(C)C)C(=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)C#CC(C)C(C(C)C)C(=O)[O-]

InChI

InChI=1S/C16H20O2/c1-11(2)15(16(17)18)13(4)7-10-14-8-5-12(3)6-9-14/h5-6,8-9,11,13,15H,1-4H3,(H,17,18)/p-1