5-(4-chlorophenyl)-2-propan-2-yl-pent-4-ynoic acid

Systemtic Name: 5-(4-chlorophenyl)-2-propan-2-yl-pent-4-ynoic acid Openeye Name: 5-(4-chlorophenyl)-2-isopropyl-pent-4-ynoic acid CAS Name: 5-(4-chlorophenyl)-2-propan-2-yl-4-pentynoic acid IUPAC Name: 5-(4-chlorophenyl)-2-propan-2-ylpent-4-ynoic acid Traditional Name: 5-(4-chlorophenyl)-2-isopropyl-pent-4-ynoic acid Formula: C14H15ClO2 MolecularWeight: 250.7207

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H15ClO2/c1-10(2)13(14(16)17)5-3-4-11-6-8-12(15)9-7-11/h6-10,13H,5H2,1-2H3,(H,16,17)