ethyl 1-[(2-oxidanylidene-1,3-dihydrobenzimidazol-5-yl)sulfonyl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[(2-oxidanylidene-1,3-dihydrobenzimidazol-5-yl)sulfonyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)sulfonyl]piperidine-4-carboxylate CAS Name: 1-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)sulfonyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)sulfonyl]piperidine-4-carboxylate Traditional Name: 1-[(2-keto-1,3-dihydrobenzimidazol-5-yl)sulfonyl]isonipecotic acid ethyl ester Formula: C15H19N3O5S MolecularWeight: 353.39346

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)NC(=O)N3

Isomeric SMILES

CCOC(=O)C1CCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)NC(=O)N3

InChI

InChI=1S/C15H19N3O5S/c1-2-23-14(19)10-5-7-18(8-6-10)24(21,22)11-3-4-12-13(9-11)17-15(20)16-12/h3-4,9-10H,2,5-8H2,1H3,(H2,16,17,20)