2-(hexylamino)pyrimidine-5-carboxylate

Systemtic Name: 2-(hexylamino)pyrimidine-5-carboxylate Openeye Name: 2-(hexylamino)pyrimidine-5-carboxylate CAS Name: 2-(hexylamino)-5-pyrimidinecarboxylate IUPAC Name: 2-(hexylamino)pyrimidine-5-carboxylate Traditional Name: 2-(hexylamino)pyrimidine-5-carboxylate Formula: C11H16N3O2- MolecularWeight: 222.26364

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCNC1=NC=C(C=N1)C(=O)[O-]

Isomeric SMILES

CCCCCCNC1=NC=C(C=N1)C(=O)[O-]

InChI

InChI=1S/C11H17N3O2/c1-2-3-4-5-6-12-11-13-7-9(8-14-11)10(15)16/h7-8H,2-6H2,1H3,(H,15,16)(H,12,13,14)/p-1