5-phenyl-3-propan-2-yl-pent-4-ynoic acid

Systemtic Name: 5-phenyl-3-propan-2-yl-pent-4-ynoic acid Openeye Name: 3-isopropyl-5-phenyl-pent-4-ynoic acid CAS Name: 5-phenyl-3-propan-2-yl-4-pentynoic acid IUPAC Name: 5-phenyl-3-propan-2-ylpent-4-ynoic acid Traditional Name: 3-isopropyl-5-phenyl-pent-4-ynoic acid Formula: C14H16O2 MolecularWeight: 216.27564

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H16O2/c1-11(2)13(10-14(15)16)9-8-12-6-4-3-5-7-12/h3-7,11,13H,10H2,1-2H3,(H,15,16)