2-methyl-2-(phenylmethyl)pent-4-ynoic acid

Systemtic Name: 2-methyl-2-(phenylmethyl)pent-4-ynoic acid Openeye Name: 2-benzyl-2-methyl-pent-4-ynoic acid CAS Name: 2-methyl-2-(phenylmethyl)-4-pentynoic acid IUPAC Name: 2-benzyl-2-methylpent-4-ynoic acid Traditional Name: 2-benzyl-2-methyl-pent-4-ynoic acid Formula: C13H14O2 MolecularWeight: 202.24906

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CC#C)(CC1=CC=CC=C1)C(=O)O

Isomeric SMILES

CC(CC#C)(CC1=CC=CC=C1)C(=O)O

InChI

InChI=1S/C13H14O2/c1-3-9-13(2,12(14)15)10-11-7-5-4-6-8-11/h1,4-8H,9-10H2,2H3,(H,14,15)