2-(azepan-1-yl)-6-propan-2-yl-pyrimidine-4-carboxylate

Systemtic Name: 2-(azepan-1-yl)-6-propan-2-yl-pyrimidine-4-carboxylate Openeye Name: 2-(azepan-1-yl)-6-isopropyl-pyrimidine-4-carboxylate CAS Name: 2-(1-azepanyl)-6-propan-2-yl-4-pyrimidinecarboxylate IUPAC Name: 2-(azepan-1-yl)-6-propan-2-ylpyrimidine-4-carboxylate Traditional Name: 2-(azepan-1-yl)-6-isopropyl-pyrimidine-4-carboxylate Formula: C14H20N3O2- MolecularWeight: 262.3275

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NC(=NC(=C1)C(=O)[O-])N2CCCCCC2

Isomeric SMILES

CC(C)C1=NC(=NC(=C1)C(=O)[O-])N2CCCCCC2

InChI

InChI=1S/C14H21N3O2/c1-10(2)11-9-12(13(18)19)16-14(15-11)17-7-5-3-4-6-8-17/h9-10H,3-8H2,1-2H3,(H,18,19)/p-1