3-[[4-(3-methylbutyl)phenoxy]methyl]benzoic acid

Systemtic Name: 3-[[4-(3-methylbutyl)phenoxy]methyl]benzoic acid Openeye Name: 3-[(4-isopentylphenoxy)methyl]benzoic acid CAS Name: 3-[[4-(3-methylbutyl)phenoxy]methyl]benzoic acid IUPAC Name: 3-[[4-(3-methylbutyl)phenoxy]methyl]benzoic acid Traditional Name: 3-[(4-isoamylphenoxy)methyl]benzoic acid Formula: C19H22O3 MolecularWeight: 298.37618

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC1=CC=C(C=C1)OCC2=CC=CC(=C2)C(=O)O

Isomeric SMILES

CC(C)CCC1=CC=C(C=C1)OCC2=CC=CC(=C2)C(=O)O

InChI

InChI=1S/C19H22O3/c1-14(2)6-7-15-8-10-18(11-9-15)22-13-16-4-3-5-17(12-16)19(20)21/h3-5,8-12,14H,6-7,13H2,1-2H3,(H,20,21)