4-[5-(4-pentoxyphenyl)thiophen-2-yl]benzoic acid

Systemtic Name: 4-[5-(4-pentoxyphenyl)thiophen-2-yl]benzoic acid Openeye Name: 4-[5-(4-pentoxyphenyl)-2-thienyl]benzoic acid CAS Name: 4-[5-(4-pentoxyphenyl)-2-thiophenyl]benzoic acid IUPAC Name: 4-[5-(4-pentoxyphenyl)thiophen-2-yl]benzoic acid Traditional Name: 4-[5-(4-amoxyphenyl)-2-thienyl]benzoic acid Formula: C22H22O3S MolecularWeight: 366.47328

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=C(C=C1)C2=CC=C(S2)C3=CC=C(C=C3)C(=O)O

Isomeric SMILES

CCCCCOC1=CC=C(C=C1)C2=CC=C(S2)C3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C22H22O3S/c1-2-3-4-15-25-19-11-9-17(10-12-19)21-14-13-20(26-21)16-5-7-18(8-6-16)22(23)24/h5-14H,2-4,15H2,1H3,(H,23,24)