2-[6-(5-chloranylpyridin-2-yl)-5-oxidanylidene-7H-pyrrolo[3,4-b]pyrazin-7-yl]-4-methyl-piperazine-1-carboxylic acid

Systemtic Name: 2-[6-(5-chloranylpyridin-2-yl)-5-oxidanylidene-7H-pyrrolo[3,4-b]pyrazin-7-yl]-4-methyl-piperazine-1-carboxylic acid Openeye Name: 2-[6-(5-chloro-2-pyridyl)-5-oxo-7H-pyrrolo[3,4-b]pyrazin-7-yl]-4-methyl-piperazine-1-carboxylic acid CAS Name: 2-[6-(5-chloro-2-pyridinyl)-5-oxo-7H-pyrrolo[3,4-b]pyrazin-7-yl]-4-methyl-1-piperazinecarboxylic acid IUPAC Name: 2-[6-(5-chloropyridin-2-yl)-5-oxo-7H-pyrrolo[3,4-b]pyrazin-7-yl]-4-methylpiperazine-1-carboxylic acid Traditional Name: 2-[6-(5-chloro-2-pyridyl)-5-keto-7H-pyrrolo[3,4-b]pyrazin-7-yl]-4-methyl-piperazine-1-carboxylic acid Formula: C17H17ClN6O3 MolecularWeight: 388.80828

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(C(C1)C2C3=NC=CN=C3C(=O)N2C4=NC=C(C=C4)Cl)C(=O)O

Isomeric SMILES

CN1CCN(C(C1)C2C3=NC=CN=C3C(=O)N2C4=NC=C(C=C4)Cl)C(=O)O

InChI

InChI=1S/C17H17ClN6O3/c1-22-6-7-23(17(26)27)11(9-22)15-13-14(20-5-4-19-13)16(25)24(15)12-3-2-10(18)8-21-12/h2-5,8,11,15H,6-7,9H2,1H3,(H,26,27)