ethyl 1-[1-(4-ethoxycarbonyl-1,2,5-trimethyl-pyrrol-3-yl)sulfonylpiperidin-3-yl]carbonylpiperidine-4-carboxylate

Systemtic Name: ethyl 1-[1-(4-ethoxycarbonyl-1,2,5-trimethyl-pyrrol-3-yl)sulfonylpiperidin-3-yl]carbonylpiperidine-4-carboxylate Openeye Name: ethyl 1-[1-(4-ethoxycarbonyl-1,2,5-trimethyl-pyrrol-3-yl)sulfonylpiperidine-3-carbonyl]piperidine-4-carboxylate CAS Name: 1-[[1-[(4-ethoxycarbonyl-1,2,5-trimethyl-3-pyrrolyl)sulfonyl]-3-piperidinyl]-oxomethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[1-(4-ethoxycarbonyl-1,2,5-trimethylpyrrol-3-yl)sulfonylpiperidine-3-carbonyl]piperidine-4-carboxylate Traditional Name: 1-[1-(4-carbethoxy-1,2,5-trimethyl-pyrrol-3-yl)sulfonylnipecotoyl]isonipecotic acid ethyl ester Formula: C24H37N3O7S MolecularWeight: 511.63148

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)C2CCCN(C2)S(=O)(=O)C3=C(N(C(=C3C(=O)OCC)C)C)C

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)C2CCCN(C2)S(=O)(=O)C3=C(N(C(=C3C(=O)OCC)C)C)C

InChI

InChI=1S/C24H37N3O7S/c1-6-33-23(29)18-10-13-26(14-11-18)22(28)19-9-8-12-27(15-19)35(31,32)21-17(4)25(5)16(3)20(21)24(30)34-7-2/h18-19H,6-15H2,1-5H3