8-ethyl-5-oxidanylidene-2-piperazin-1-yl-pyrido[2,3-d]pyrimidine-6-carboxylate; molybdenum; oxygen(2-)

Systemtic Name: 8-ethyl-5-oxidanylidene-2-piperazin-1-yl-pyrido[2,3-d]pyrimidine-6-carboxylate; molybdenum; oxygen(2-) Openeye Name: 8-ethyl-5-oxo-2-piperazin-1-yl-pyrido[2,3-d]pyrimidine-6-carboxylate; molybdenum; oxygen(2-) CAS Name: 8-ethyl-5-oxo-2-(1-piperazinyl)-6-pyrido[2,3-d]pyrimidinecarboxylate; molybdenum; oxygen(2-) IUPAC Name: 8-ethyl-5-oxo-2-piperazin-1-ylpyrido[2,3-d]pyrimidine-6-carboxylate; molybdenum; oxygen(2-) Traditional Name: 8-ethyl-5-keto-2-piperazino-pyrido[2,3-d]pyrimidine-6-carboxylate; molybdenum; oxygen(2-) Formula: C28H32MoN10O8-6 MolecularWeight: 732.55588

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=O)C2=CN=C(N=C21)N3CCNCC3)C(=O)[O-].CCN1C=C(C(=O)C2=CN=C(N=C21)N3CCNCC3)C(=O)[O-].[O-2].[O-2].[Mo]

Isomeric SMILES

CCN1C=C(C(=O)C2=CN=C(N=C21)N3CCNCC3)C(=O)[O-].CCN1C=C(C(=O)C2=CN=C(N=C21)N3CCNCC3)C(=O)[O-].[O-2].[O-2].[Mo]

InChI

InChI=1S/2C14H17N5O3.Mo.2O/c2*1-2-18-8-10(13(21)22)11(20)9-7-16-14(17-12(9)18)19-5-3-15-4-6-19;;;/h2*7-8,15H,2-6H2,1H3,(H,21,22);;;/q;;;2*-2/p-2