2-(phenylmethyl)hex-5-ynoic acid

Systemtic Name: 2-(phenylmethyl)hex-5-ynoic acid Openeye Name: 2-benzylhex-5-ynoic acid CAS Name: 2-(phenylmethyl)-5-hexynoic acid IUPAC Name: 2-benzylhex-5-ynoic acid Traditional Name: 2-benzylhex-5-ynoic acid Formula: C13H14O2 MolecularWeight: 202.24906

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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