4-octoxybenzoate; 4-phenylphenol

Systemtic Name: 4-octoxybenzoate; 4-phenylphenol Openeye Name: 4-octoxybenzoate; 4-phenylphenol CAS Name: 4-octoxybenzoate; 4-phenylphenol IUPAC Name: 4-octoxybenzoate; 4-phenylphenol Traditional Name: 4-octoxybenzoate; 4-phenylphenol Formula: C27H31O4- MolecularWeight: 419.53264

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC=C(C=C1)C(=O)[O-].C1=CC=C(C=C1)C2=CC=C(C=C2)O

Isomeric SMILES

CCCCCCCCOC1=CC=C(C=C1)C(=O)[O-].C1=CC=C(C=C1)C2=CC=C(C=C2)O

InChI

InChI=1S/C15H22O3.C12H10O/c1-2-3-4-5-6-7-12-18-14-10-8-13(9-11-14)15(16)17;13-12-8-6-11(7-9-12)10-4-2-1-3-5-10/h8-11H,2-7,12H2,1H3,(H,16,17);1-9,13H/p-1