ethyl 1-(2-chloranylpyrimidin-5-yl)sulfonylpiperidine-4-carboxylate

Systemtic Name: ethyl 1-(2-chloranylpyrimidin-5-yl)sulfonylpiperidine-4-carboxylate Openeye Name: ethyl 1-(2-chloropyrimidin-5-yl)sulfonylpiperidine-4-carboxylate CAS Name: 1-[(2-chloro-5-pyrimidinyl)sulfonyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(2-chloropyrimidin-5-yl)sulfonylpiperidine-4-carboxylate Traditional Name: 1-(2-chloropyrimidin-5-yl)sulfonylisonipecotic acid ethyl ester Formula: C12H16ClN3O4S MolecularWeight: 333.79114

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)S(=O)(=O)C2=CN=C(N=C2)Cl

Isomeric SMILES

CCOC(=O)C1CCN(CC1)S(=O)(=O)C2=CN=C(N=C2)Cl

InChI

InChI=1S/C12H16ClN3O4S/c1-2-20-11(17)9-3-5-16(6-4-9)21(18,19)10-7-14-12(13)15-8-10/h7-9H,2-6H2,1H3