6-[(2,6-dimethoxypyrimidin-4-yl)carbamoyl]cyclohex-3-ene-1-carboxylic acid

Systemtic Name: 6-[(2,6-dimethoxypyrimidin-4-yl)carbamoyl]cyclohex-3-ene-1-carboxylic acid Openeye Name: 6-[(2,6-dimethoxypyrimidin-4-yl)carbamoyl]cyclohex-3-ene-1-carboxylic acid CAS Name: 6-[[(2,6-dimethoxy-4-pyrimidinyl)amino]-oxomethyl]-1-cyclohex-3-enecarboxylic acid IUPAC Name: 6-[(2,6-dimethoxypyrimidin-4-yl)carbamoyl]cyclohex-3-ene-1-carboxylic acid Traditional Name: 6-[(2,6-dimethoxypyrimidin-4-yl)carbamoyl]cyclohex-3-ene-1-carboxylic acid Formula: C14H17N3O5 MolecularWeight: 307.30188

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC(=NC(=C1)NC(=O)C2CC=CCC2C(=O)O)OC

Isomeric SMILES

COC1=NC(=NC(=C1)NC(=O)C2CC=CCC2C(=O)O)OC

InChI

InChI=1S/C14H17N3O5/c1-21-11-7-10(16-14(17-11)22-2)15-12(18)8-5-3-4-6-9(8)13(19)20/h3-4,7-9H,5-6H2,1-2H3,(H,19,20)(H,15,16,17,18)