N6,N7-diphenyltridecane-6,7-diimine; 6-ethyl-2,3-bis(oxidanyl)benzoate; palladium(2+)

Systemtic Name: N6,N7-diphenyltridecane-6,7-diimine; 6-ethyl-2,3-bis(oxidanyl)benzoate; palladium(2+) Openeye Name: N6,N7-diphenyltridecane-6,7-diimine; 6-ethyl-2,3-dihydroxy-benzoate; palladium(2+) CAS Name: N6,N7-diphenyltridecane-6,7-diimine; 6-ethyl-2,3-dihydroxybenzoate; palladium(2+) IUPAC Name: 6-N,7-N-diphenyltridecane-6,7-diimine; 6-ethyl-2,3-dihydroxybenzoate; palladium(2+) Traditional Name: (1-amyl-2-phenylimino-octylidene)-phenyl-amine; 6-ethyl-2,3-dihydroxy-benzoate; palladium(2+) Formula: C43H52N2O8Pd MolecularWeight: 831.30158

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(=NC1=CC=CC=C1)C(=NC2=CC=CC=C2)CCCCC.CCC1=C(C(=C(C=C1)O)O)C(=O)[O-].CCC1=C(C(=C(C=C1)O)O)C(=O)[O-].[Pd+2]

Isomeric SMILES

CCCCCCC(=NC1=CC=CC=C1)C(=NC2=CC=CC=C2)CCCCC.CCC1=C(C(=C(C=C1)O)O)C(=O)[O-].CCC1=C(C(=C(C=C1)O)O)C(=O)[O-].[Pd+2]

InChI

InChI=1S/C25H34N2.2C9H10O4.Pd/c1-3-5-7-15-21-25(27-23-18-13-9-14-19-23)24(20-10-6-4-2)26-22-16-11-8-12-17-22;2*1-2-5-3-4-6(10)8(11)7(5)9(12)13;/h8-9,11-14,16-19H,3-7,10,15,20-21H2,1-2H3;2*3-4,10-11H,2H2,1H3,(H,12,13);/q;;;+2/p-2