3-oxidanyl-7-prop-2-enyl-naphthalene-2-carboxylic acid; zirconium

Systemtic Name: 3-oxidanyl-7-prop-2-enyl-naphthalene-2-carboxylic acid; zirconium Openeye Name: 7-allyl-3-hydroxy-naphthalene-2-carboxylic acid; zirconium CAS Name: 3-hydroxy-7-prop-2-enyl-2-naphthalenecarboxylic acid; zirconium IUPAC Name: 3-hydroxy-7-prop-2-enylnaphthalene-2-carboxylic acid; zirconium Traditional Name: 7-allyl-3-hydroxy-2-naphthoic acid; zirconium Formula: C28H24O6Zr MolecularWeight: 547.71056

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Descriptors Computed from Structure

Canonical SMILES:

C=CCC1=CC2=CC(=C(C=C2C=C1)O)C(=O)O.C=CCC1=CC2=CC(=C(C=C2C=C1)O)C(=O)O.[Zr]

Isomeric SMILES

C=CCC1=CC2=CC(=C(C=C2C=C1)O)C(=O)O.C=CCC1=CC2=CC(=C(C=C2C=C1)O)C(=O)O.[Zr]

InChI

InChI=1S/2C14H12O3.Zr/c2*1-2-3-9-4-5-10-8-13(15)12(14(16)17)7-11(10)6-9;/h2*2,4-8,15H,1,3H2,(H,16,17);