2-(8-azaspiro[4.5]decan-8-yl)-1-methyl-6-oxidanylidene-5-phenylmethoxy-pyrimidine-4-carboxylic acid

Systemtic Name: 2-(8-azaspiro[4.5]decan-8-yl)-1-methyl-6-oxidanylidene-5-phenylmethoxy-pyrimidine-4-carboxylic acid Openeye Name: 2-(8-azaspiro[4.5]decan-8-yl)-5-benzyloxy-1-methyl-6-oxo-pyrimidine-4-carboxylic acid CAS Name: 2-(8-azaspiro[4.5]decan-8-yl)-1-methyl-6-oxo-5-phenylmethoxy-4-pyrimidinecarboxylic acid IUPAC Name: 2-(8-azaspiro[4.5]decan-8-yl)-1-methyl-6-oxo-5-phenylmethoxypyrimidine-4-carboxylic acid Traditional Name: 2-(8-azaspiro[4.5]decan-8-yl)-5-benzoxy-6-keto-1-methyl-pyrimidine-4-carboxylic acid Formula: C22H27N3O4 MolecularWeight: 397.46748

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C(=C(N=C1N2CCC3(CCCC3)CC2)C(=O)O)OCC4=CC=CC=C4

Isomeric SMILES

CN1C(=O)C(=C(N=C1N2CCC3(CCCC3)CC2)C(=O)O)OCC4=CC=CC=C4

InChI

InChI=1S/C22H27N3O4/c1-24-19(26)18(29-15-16-7-3-2-4-8-16)17(20(27)28)23-21(24)25-13-11-22(12-14-25)9-5-6-10-22/h2-4,7-8H,5-6,9-15H2,1H3,(H,27,28)