ethyl 1-(4-pyrrolidin-1-ylsulfonylphenyl)sulfonylpiperidine-4-carboxylate

Systemtic Name: ethyl 1-(4-pyrrolidin-1-ylsulfonylphenyl)sulfonylpiperidine-4-carboxylate Openeye Name: ethyl 1-(4-pyrrolidin-1-ylsulfonylphenyl)sulfonylpiperidine-4-carboxylate CAS Name: 1-[4-(1-pyrrolidinylsulfonyl)phenyl]sulfonyl-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(4-pyrrolidin-1-ylsulfonylphenyl)sulfonylpiperidine-4-carboxylate Traditional Name: 1-(4-pyrrolidinosulfonylphenyl)sulfonylisonipecotic acid ethyl ester Formula: C18H26N2O6S2 MolecularWeight: 430.53884

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCCC3

Isomeric SMILES

CCOC(=O)C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C18H26N2O6S2/c1-2-26-18(21)15-9-13-20(14-10-15)28(24,25)17-7-5-16(6-8-17)27(22,23)19-11-3-4-12-19/h5-8,15H,2-4,9-14H2,1H3