2-[4-(2-hexoxy-2-oxidanylidene-ethyl)phenyl]benzoic acid

Systemtic Name: 2-[4-(2-hexoxy-2-oxidanylidene-ethyl)phenyl]benzoic acid Openeye Name: 2-[4-(2-hexoxy-2-oxo-ethyl)phenyl]benzoic acid CAS Name: 2-[4-(2-hexoxy-2-oxoethyl)phenyl]benzoic acid IUPAC Name: 2-[4-(2-hexoxy-2-oxoethyl)phenyl]benzoic acid Traditional Name: 2-[4-(2-hexoxy-2-keto-ethyl)phenyl]benzoic acid Formula: C21H24O4 MolecularWeight: 340.41286

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC(=O)CC1=CC=C(C=C1)C2=CC=CC=C2C(=O)O

Isomeric SMILES

CCCCCCOC(=O)CC1=CC=C(C=C1)C2=CC=CC=C2C(=O)O

InChI

InChI=1S/C21H24O4/c1-2-3-4-7-14-25-20(22)15-16-10-12-17(13-11-16)18-8-5-6-9-19(18)21(23)24/h5-6,8-13H,2-4,7,14-15H2,1H3,(H,23,24)