3-[1-(4-cyanophenyl)-2-oxidanyl-propyl]benzoic acid

Systemtic Name: 3-[1-(4-cyanophenyl)-2-oxidanyl-propyl]benzoic acid Openeye Name: 3-[1-(4-cyanophenyl)-2-hydroxy-propyl]benzoic acid CAS Name: 3-[1-(4-cyanophenyl)-2-hydroxypropyl]benzoic acid IUPAC Name: 3-[1-(4-cyanophenyl)-2-hydroxypropyl]benzoic acid Traditional Name: 3-[1-(4-cyanophenyl)-2-hydroxy-propyl]benzoic acid Formula: C17H15NO3 MolecularWeight: 281.3059

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C1=CC=C(C=C1)C#N)C2=CC=CC(=C2)C(=O)O)O

Isomeric SMILES

CC(C(C1=CC=C(C=C1)C#N)C2=CC=CC(=C2)C(=O)O)O

InChI

InChI=1S/C17H15NO3/c1-11(19)16(13-7-5-12(10-18)6-8-13)14-3-2-4-15(9-14)17(20)21/h2-9,11,16,19H,1H3,(H,20,21)