1-methyl-6-oxidanylidene-5-phenylmethoxy-2-piperazin-1-yl-pyrimidine-4-carboxylic acid

Systemtic Name: 1-methyl-6-oxidanylidene-5-phenylmethoxy-2-piperazin-1-yl-pyrimidine-4-carboxylic acid Openeye Name: 5-benzyloxy-1-methyl-6-oxo-2-piperazin-1-yl-pyrimidine-4-carboxylic acid CAS Name: 1-methyl-6-oxo-5-phenylmethoxy-2-(1-piperazinyl)-4-pyrimidinecarboxylic acid IUPAC Name: 1-methyl-6-oxo-5-phenylmethoxy-2-piperazin-1-ylpyrimidine-4-carboxylic acid Traditional Name: 5-benzoxy-6-keto-1-methyl-2-piperazino-pyrimidine-4-carboxylic acid Formula: C17H20N4O4 MolecularWeight: 344.3651

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C(=C(N=C1N2CCNCC2)C(=O)O)OCC3=CC=CC=C3

Isomeric SMILES

CN1C(=O)C(=C(N=C1N2CCNCC2)C(=O)O)OCC3=CC=CC=C3

InChI

InChI=1S/C17H20N4O4/c1-20-15(22)14(25-11-12-5-3-2-4-6-12)13(16(23)24)19-17(20)21-9-7-18-8-10-21/h2-6,18H,7-11H2,1H3,(H,23,24)