zinc; 2-methanoyloxybenzoate; 3-octylphenol

Systemtic Name: zinc; 2-methanoyloxybenzoate; 3-octylphenol Openeye Name: zinc; 2-formyloxybenzoate; 3-octylphenol CAS Name: zinc; 2-formyloxybenzoate; 3-octylphenol IUPAC Name: zinc; 2-formyloxybenzoate; 3-octylphenol Traditional Name: zinc; 2-formyloxybenzoate; 3-octylphenol Formula: C30H32O9Zn MolecularWeight: 601.97868

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC(=CC=C1)O.C1=CC=C(C(=C1)C(=O)[O-])OC=O.C1=CC=C(C(=C1)C(=O)[O-])OC=O.[Zn+2]

Isomeric SMILES

CCCCCCCCC1=CC(=CC=C1)O.C1=CC=C(C(=C1)C(=O)[O-])OC=O.C1=CC=C(C(=C1)C(=O)[O-])OC=O.[Zn+2]

InChI

InChI=1S/C14H22O.2C8H6O4.Zn/c1-2-3-4-5-6-7-9-13-10-8-11-14(15)12-13;2*9-5-12-7-4-2-1-3-6(7)8(10)11;/h8,10-12,15H,2-7,9H2,1H3;2*1-5H,(H,10,11);/q;;;+2/p-2