2-(azepan-1-yl)-5-chloranyl-pyrimidine-4-carboxylate

Systemtic Name: 2-(azepan-1-yl)-5-chloranyl-pyrimidine-4-carboxylate Openeye Name: 2-(azepan-1-yl)-5-chloro-pyrimidine-4-carboxylate CAS Name: 2-(1-azepanyl)-5-chloro-4-pyrimidinecarboxylate IUPAC Name: 2-(azepan-1-yl)-5-chloropyrimidine-4-carboxylate Traditional Name: 2-(azepan-1-yl)-5-chloro-pyrimidine-4-carboxylate Formula: C11H13ClN3O2- MolecularWeight: 254.69282

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=NC=C(C(=N2)C(=O)[O-])Cl

Isomeric SMILES

C1CCCN(CC1)C2=NC=C(C(=N2)C(=O)[O-])Cl

InChI

InChI=1S/C11H14ClN3O2/c12-8-7-13-11(14-9(8)10(16)17)15-5-3-1-2-4-6-15/h7H,1-6H2,(H,16,17)/p-1