cyclohexane-1,2-diamine; 6-methyl-3-(3-phenylpropanoyl)pyran-2,4-dione; platinum; hydrate

Systemtic Name: cyclohexane-1,2-diamine; 6-methyl-3-(3-phenylpropanoyl)pyran-2,4-dione; platinum; hydrate Openeye Name: cyclohexane-1,2-diamine; 6-methyl-3-(3-phenylpropanoyl)pyran-2,4-dione; platinum; hydrate CAS Name: cyclohexane-1,2-diamine; 6-methyl-3-(1-oxo-3-phenylpropyl)pyran-2,4-dione; platinum; hydrate IUPAC Name: cyclohexane-1,2-diamine; 6-methyl-3-(3-phenylpropanoyl)pyran-2,4-dione; platinum; hydrate Traditional Name: (2-aminocyclohexyl)amine; 3-hydrocinnamoyl-6-methyl-pyran-2,4-quinone; platinum; hydrate Formula: C21H30N2O5Pt MolecularWeight: 585.5513

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)C(C(=O)O1)C(=O)CCC2=CC=CC=C2.C1CCC(C(C1)N)N.O.[Pt]

Isomeric SMILES

CC1=CC(=O)C(C(=O)O1)C(=O)CCC2=CC=CC=C2.C1CCC(C(C1)N)N.O.[Pt]

InChI

InChI=1S/C15H14O4.C6H14N2.H2O.Pt/c1-10-9-13(17)14(15(18)19-10)12(16)8-7-11-5-3-2-4-6-11;7-5-3-1-2-4-6(5)8;;/h2-6,9,14H,7-8H2,1H3;5-6H,1-4,7-8H2;1H2;