3-[4-(4-butoxyphenyl)phenyl]furan-2-carboxylic acid

Systemtic Name: 3-[4-(4-butoxyphenyl)phenyl]furan-2-carboxylic acid Openeye Name: 3-[4-(4-butoxyphenyl)phenyl]furan-2-carboxylic acid CAS Name: 3-[4-(4-butoxyphenyl)phenyl]-2-furancarboxylic acid IUPAC Name: 3-[4-(4-butoxyphenyl)phenyl]furan-2-carboxylic acid Traditional Name: 3-[4-(4-butoxyphenyl)phenyl]-2-furoic acid Formula: C21H20O4 MolecularWeight: 336.3811

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C3=C(OC=C3)C(=O)O

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C3=C(OC=C3)C(=O)O

InChI

InChI=1S/C21H20O4/c1-2-3-13-24-18-10-8-16(9-11-18)15-4-6-17(7-5-15)19-12-14-25-20(19)21(22)23/h4-12,14H,2-3,13H2,1H3,(H,22,23)