4-(azepan-1-yl)-3,5,6-tris(chloranyl)pyridine-2-carboxylate

Systemtic Name: 4-(azepan-1-yl)-3,5,6-tris(chloranyl)pyridine-2-carboxylate Openeye Name: 4-(azepan-1-yl)-3,5,6-trichloro-pyridine-2-carboxylate CAS Name: 4-(1-azepanyl)-3,5,6-trichloro-2-pyridinecarboxylate IUPAC Name: 4-(azepan-1-yl)-3,5,6-trichloropyridine-2-carboxylate Traditional Name: 4-(azepan-1-yl)-3,5,6-trichloro-picolinate Formula: C12H12Cl3N2O2- MolecularWeight: 322.59488

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=C(C(=NC(=C2Cl)Cl)C(=O)[O-])Cl

Isomeric SMILES

C1CCCN(CC1)C2=C(C(=NC(=C2Cl)Cl)C(=O)[O-])Cl

InChI

InChI=1S/C12H13Cl3N2O2/c13-7-9(12(18)19)16-11(15)8(14)10(7)17-5-3-1-2-4-6-17/h1-6H2,(H,18,19)/p-1