4-[4-(3-methylpentanoyloxy)phenyl]benzoic acid

Systemtic Name: 4-[4-(3-methylpentanoyloxy)phenyl]benzoic acid Openeye Name: 4-[4-(3-methylpentanoyloxy)phenyl]benzoic acid CAS Name: 4-[4-(3-methyl-1-oxopentoxy)phenyl]benzoic acid IUPAC Name: 4-[4-(3-methylpentanoyloxy)phenyl]benzoic acid Traditional Name: 4-[4-(3-methylpentanoyloxy)phenyl]benzoic acid Formula: C19H20O4 MolecularWeight: 312.3597

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)CC(=O)OC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)O

Isomeric SMILES

CCC(C)CC(=O)OC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C19H20O4/c1-3-13(2)12-18(20)23-17-10-8-15(9-11-17)14-4-6-16(7-5-14)19(21)22/h4-11,13H,3,12H2,1-2H3,(H,21,22)