ethyl 1-[3,4,5-triacetyloxy-6-[(6-pyrrol-1-ylpyridin-3-yl)carbonylamino]oxan-2-yl]carbonylpiperidine-4-carboxylate

Systemtic Name: ethyl 1-[3,4,5-triacetyloxy-6-[(6-pyrrol-1-ylpyridin-3-yl)carbonylamino]oxan-2-yl]carbonylpiperidine-4-carboxylate Openeye Name: ethyl 1-[3,4,5-triacetoxy-6-[(6-pyrrol-1-ylpyridine-3-carbonyl)amino]tetrahydropyran-2-carbonyl]piperidine-4-carboxylate CAS Name: 1-[oxo-[3,4,5-triacetyloxy-6-[[oxo-[6-(1-pyrrolyl)-3-pyridinyl]methyl]amino]-2-oxanyl]methyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[3,4,5-triacetyloxy-6-[(6-pyrrol-1-ylpyridine-3-carbonyl)amino]oxane-2-carbonyl]piperidine-4-carboxylate Traditional Name: 1-[3,4,5-triacetoxy-6-[(6-pyrrol-1-ylnicotinoyl)amino]tetrahydropyran-2-carbonyl]isonipecotic acid ethyl ester Formula: C30H36N4O11 MolecularWeight: 628.62704

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)C2C(C(C(C(O2)NC(=O)C3=CN=C(C=C3)N4C=CC=C4)OC(=O)C)OC(=O)C)OC(=O)C

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)C2C(C(C(C(O2)NC(=O)C3=CN=C(C=C3)N4C=CC=C4)OC(=O)C)OC(=O)C)OC(=O)C

InChI

InChI=1S/C30H36N4O11/c1-5-41-30(40)20-10-14-34(15-11-20)29(39)26-24(43-18(3)36)23(42-17(2)35)25(44-19(4)37)28(45-26)32-27(38)21-8-9-22(31-16-21)33-12-6-7-13-33/h6-9,12-13,16,20,23-26,28H,5,10-11,14-15H2,1-4H3,(H,32,38)