4-[3-(4-ethylphenyl)-2-oxidanyl-propoxy]benzoic acid

Systemtic Name: 4-[3-(4-ethylphenyl)-2-oxidanyl-propoxy]benzoic acid Openeye Name: 4-[3-(4-ethylphenyl)-2-hydroxy-propoxy]benzoic acid CAS Name: 4-[3-(4-ethylphenyl)-2-hydroxypropoxy]benzoic acid IUPAC Name: 4-[3-(4-ethylphenyl)-2-hydroxypropoxy]benzoic acid Traditional Name: 4-[3-(4-ethylphenyl)-2-hydroxy-propoxy]benzoic acid Formula: C18H20O4 MolecularWeight: 300.349

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)CC(COC2=CC=C(C=C2)C(=O)O)O

Isomeric SMILES

CCC1=CC=C(C=C1)CC(COC2=CC=C(C=C2)C(=O)O)O

InChI

InChI=1S/C18H20O4/c1-2-13-3-5-14(6-4-13)11-16(19)12-22-17-9-7-15(8-10-17)18(20)21/h3-10,16,19H,2,11-12H2,1H3,(H,20,21)