3-(hydroxymethyl)-4-phenyl-butanoate

Systemtic Name: 3-(hydroxymethyl)-4-phenyl-butanoate Openeye Name: 3-benzyl-4-hydroxy-butanoate CAS Name: 3-(hydroxymethyl)-4-phenylbutanoate IUPAC Name: 3-benzyl-4-hydroxybutanoate Traditional Name: 3-benzyl-4-hydroxy-butyrate Formula: C11H13O3- MolecularWeight: 193.21912

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(CC(=O)[O-])CO

Isomeric SMILES

C1=CC=C(C=C1)CC(CC(=O)[O-])CO

InChI

InChI=1S/C11H14O3/c12-8-10(7-11(13)14)6-9-4-2-1-3-5-9/h1-5,10,12H,6-8H2,(H,13,14)/p-1