3-(3-decoxy-4-phenyl-phenyl)-2-oxidanyl-benzoate

Systemtic Name: 3-(3-decoxy-4-phenyl-phenyl)-2-oxidanyl-benzoate Openeye Name: 3-(3-decoxy-4-phenyl-phenyl)-2-hydroxy-benzoate CAS Name: 3-(3-decoxy-4-phenylphenyl)-2-hydroxybenzoate IUPAC Name: 3-(3-decoxy-4-phenylphenyl)-2-hydroxybenzoate Traditional Name: 3-(3-decoxy-4-phenyl-phenyl)-2-hydroxy-benzoate Formula: C29H33O4- MolecularWeight: 445.56992

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC1=C(C=CC(=C1)C2=C(C(=CC=C2)C(=O)[O-])O)C3=CC=CC=C3

Isomeric SMILES

CCCCCCCCCCOC1=C(C=CC(=C1)C2=C(C(=CC=C2)C(=O)[O-])O)C3=CC=CC=C3

InChI

InChI=1S/C29H34O4/c1-2-3-4-5-6-7-8-12-20-33-27-21-23(18-19-24(27)22-14-10-9-11-15-22)25-16-13-17-26(28(25)30)29(31)32/h9-11,13-19,21,30H,2-8,12,20H2,1H3,(H,31,32)/p-1