4-prop-2-enylbenzene-1,2-diol; zirconium

Systemtic Name: 4-prop-2-enylbenzene-1,2-diol; zirconium Openeye Name: 4-allylbenzene-1,2-diol; zirconium CAS Name: 4-prop-2-enylbenzene-1,2-diol; zirconium IUPAC Name: 4-prop-2-enylbenzene-1,2-diol; zirconium Traditional Name: 4-allylpyrocatechol; zirconium Formula: C18H20O4Zr MolecularWeight: 391.573

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/2C9H10O2.Zr/c2*1-2-3-7-4-5-8(10)9(11)6-7;/h2*2,4-6,10-11H,1,3H2;