ethyl 1-[1-(1H-imidazol-5-ylsulfonyl)piperidin-4-yl]carbonylpiperidine-3-carboxylate

Systemtic Name: ethyl 1-[1-(1H-imidazol-5-ylsulfonyl)piperidin-4-yl]carbonylpiperidine-3-carboxylate Openeye Name: ethyl 1-[1-(1H-imidazol-5-ylsulfonyl)piperidine-4-carbonyl]piperidine-3-carboxylate CAS Name: 1-[[1-(1H-imidazol-5-ylsulfonyl)-4-piperidinyl]-oxomethyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[1-(1H-imidazol-5-ylsulfonyl)piperidine-4-carbonyl]piperidine-3-carboxylate Traditional Name: 1-[1-(1H-imidazol-5-ylsulfonyl)isonipecotoyl]nipecotic acid ethyl ester Formula: C17H26N4O5S MolecularWeight: 398.47714

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)C(=O)C2CCN(CC2)S(=O)(=O)C3=CN=CN3

Isomeric SMILES

CCOC(=O)C1CCCN(C1)C(=O)C2CCN(CC2)S(=O)(=O)C3=CN=CN3

InChI

InChI=1S/C17H26N4O5S/c1-2-26-17(23)14-4-3-7-20(11-14)16(22)13-5-8-21(9-6-13)27(24,25)15-10-18-12-19-15/h10,12-14H,2-9,11H2,1H3,(H,18,19)