cyclohexane-1,2-diamine; 3-[3-(3-hydroxyphenyl)propanoyl]-6-methyl-pyran-2,4-dione; platinum; hydrate

Systemtic Name: cyclohexane-1,2-diamine; 3-[3-(3-hydroxyphenyl)propanoyl]-6-methyl-pyran-2,4-dione; platinum; hydrate Openeye Name: cyclohexane-1,2-diamine; 3-[3-(3-hydroxyphenyl)propanoyl]-6-methyl-pyran-2,4-dione; platinum; hydrate CAS Name: cyclohexane-1,2-diamine; 3-[3-(3-hydroxyphenyl)-1-oxopropyl]-6-methylpyran-2,4-dione; platinum; hydrate IUPAC Name: cyclohexane-1,2-diamine; 3-[3-(3-hydroxyphenyl)propanoyl]-6-methylpyran-2,4-dione; platinum; hydrate Traditional Name: (2-aminocyclohexyl)amine; 3-[3-(3-hydroxyphenyl)propanoyl]-6-methyl-pyran-2,4-quinone; platinum; hydrate Formula: C21H30N2O6Pt MolecularWeight: 601.5507

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H14O5.C6H14N2.H2O.Pt/c1-9-7-13(18)14(15(19)20-9)12(17)6-5-10-3-2-4-11(16)8-10;7-5-3-1-2-4-6(5)8;;/h2-4,7-8,14,16H,5-6H2,1H3;5-6H,1-4,7-8H2;1H2;