2-[[4-(3-methoxy-3-oxidanylidene-propyl)phenoxy]methyl]benzoic acid

Systemtic Name: 2-[[4-(3-methoxy-3-oxidanylidene-propyl)phenoxy]methyl]benzoic acid Openeye Name: 2-[[4-(3-methoxy-3-oxo-propyl)phenoxy]methyl]benzoic acid CAS Name: 2-[[4-(3-methoxy-3-oxopropyl)phenoxy]methyl]benzoic acid IUPAC Name: 2-[[4-(3-methoxy-3-oxopropyl)phenoxy]methyl]benzoic acid Traditional Name: 2-[[4-(3-keto-3-methoxy-propyl)phenoxy]methyl]benzoic acid Formula: C18H18O5 MolecularWeight: 314.33252

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCC1=CC=C(C=C1)OCC2=CC=CC=C2C(=O)O

Isomeric SMILES

COC(=O)CCC1=CC=C(C=C1)OCC2=CC=CC=C2C(=O)O

InChI

InChI=1S/C18H18O5/c1-22-17(19)11-8-13-6-9-15(10-7-13)23-12-14-4-2-3-5-16(14)18(20)21/h2-7,9-10H,8,11-12H2,1H3,(H,20,21)