2-[3-tert-butyl-5-(4,5-dihydro-1,3-oxazol-2-yl)benzene-6-id-1-yl]-4,5-dihydro-1,3-oxazole; rhodium(3+); diethanoate; hydrate

Systemtic Name: 2-[3-tert-butyl-5-(4,5-dihydro-1,3-oxazol-2-yl)benzene-6-id-1-yl]-4,5-dihydro-1,3-oxazole; rhodium(3+); diethanoate; hydrate Openeye Name: 2-[3-tert-butyl-5-(4,5-dihydrooxazol-2-yl)benzene-6-id-1-yl]-4,5-dihydrooxazole; rhodium(3+); diacetate; hydrate CAS Name: 2-[3-tert-butyl-5-(4,5-dihydrooxazol-2-yl)-1-benzene-6-idyl]-4,5-dihydrooxazole; rhodium(3+); diacetate; hydrate IUPAC Name: 2-[3-tert-butyl-5-(4,5-dihydro-1,3-oxazol-2-yl)benzene-6-id-1-yl]-4,5-dihydro-1,3-oxazole; rhodium(3+); diacetate; hydrate Traditional Name: 2-[3-tert-butyl-5-(2-oxazolin-2-yl)benzene-6-id-1-yl]-2-oxazoline; rhodium(3+); diacetate; hydrate Formula: C20H27N2O7Rh MolecularWeight: 510.34308

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)[O-].CC(=O)[O-].CC(C)(C)C1=CC(=[C-]C(=C1)C2=NCCO2)C3=NCCO3.O.[Rh+3]

Isomeric SMILES

CC(=O)[O-].CC(=O)[O-].CC(C)(C)C1=CC(=[C-]C(=C1)C2=NCCO2)C3=NCCO3.O.[Rh+3]

InChI

InChI=1S/C16H19N2O2.2C2H4O2.H2O.Rh/c1-16(2,3)13-9-11(14-17-4-6-19-14)8-12(10-13)15-18-5-7-20-15;2*1-2(3)4;;/h9-10H,4-7H2,1-3H3;2*1H3,(H,3,4);1H2;/q-1;;;;+3/p-2