3-(3-butoxy-2-methyl-butoxy)-4-phenyl-benzoic acid

Systemtic Name: 3-(3-butoxy-2-methyl-butoxy)-4-phenyl-benzoic acid Openeye Name: 3-(3-butoxy-2-methyl-butoxy)-4-phenyl-benzoic acid CAS Name: 3-(3-butoxy-2-methylbutoxy)-4-phenylbenzoic acid IUPAC Name: 3-(3-butoxy-2-methylbutoxy)-4-phenylbenzoic acid Traditional Name: 3-(3-butoxy-2-methyl-butoxy)-4-phenyl-benzoic acid Formula: C22H28O4 MolecularWeight: 356.45532

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(C)C(C)COC1=C(C=CC(=C1)C(=O)O)C2=CC=CC=C2

Isomeric SMILES

CCCCOC(C)C(C)COC1=C(C=CC(=C1)C(=O)O)C2=CC=CC=C2

InChI

InChI=1S/C22H28O4/c1-4-5-13-25-17(3)16(2)15-26-21-14-19(22(23)24)11-12-20(21)18-9-7-6-8-10-18/h6-12,14,16-17H,4-5,13,15H2,1-3H3,(H,23,24)