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

Systemtic Name: cyclohexane-1,2-diamine; 3-[3-(2-methoxyphenyl)propanoyl]-6-methyl-pyran-2,4-dione; platinum; hydrate Openeye Name: cyclohexane-1,2-diamine; 3-[3-(2-methoxyphenyl)propanoyl]-6-methyl-pyran-2,4-dione; platinum; hydrate CAS Name: cyclohexane-1,2-diamine; 3-[3-(2-methoxyphenyl)-1-oxopropyl]-6-methylpyran-2,4-dione; platinum; hydrate IUPAC Name: cyclohexane-1,2-diamine; 3-[3-(2-methoxyphenyl)propanoyl]-6-methylpyran-2,4-dione; platinum; hydrate Traditional Name: (2-aminocyclohexyl)amine; 3-[3-(2-methoxyphenyl)propanoyl]-6-methyl-pyran-2,4-quinone; platinum; hydrate Formula: C22H32N2O6Pt MolecularWeight: 615.57728

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)C(C(=O)O1)C(=O)CCC2=CC=CC=C2OC.C1CCC(C(C1)N)N.O.[Pt]

Isomeric SMILES

CC1=CC(=O)C(C(=O)O1)C(=O)CCC2=CC=CC=C2OC.C1CCC(C(C1)N)N.O.[Pt]

InChI

InChI=1S/C16H16O5.C6H14N2.H2O.Pt/c1-10-9-13(18)15(16(19)21-10)12(17)8-7-11-5-3-4-6-14(11)20-2;7-5-3-1-2-4-6(5)8;;/h3-6,9,15H,7-8H2,1-2H3;5-6H,1-4,7-8H2;1H2;