O1-tert-butyl O3-[2-oxidanylidene-2-(4-pyrrolidin-1-ylsulfonylphenyl)ethyl] piperidine-1,3-dicarboxylate

Systemtic Name: O1-tert-butyl O3-[2-oxidanylidene-2-(4-pyrrolidin-1-ylsulfonylphenyl)ethyl] piperidine-1,3-dicarboxylate Openeye Name: O1-tert-butyl O3-[2-oxo-2-(4-pyrrolidin-1-ylsulfonylphenyl)ethyl] piperidine-1,3-dicarboxylate CAS Name: piperidine-1,3-dicarboxylic acid O1-tert-butyl ester O3-[2-oxo-2-[4-(1-pyrrolidinylsulfonyl)phenyl]ethyl] ester IUPAC Name: 1-O-tert-butyl 3-O-[2-oxo-2-(4-pyrrolidin-1-ylsulfonylphenyl)ethyl] piperidine-1,3-dicarboxylate Traditional Name: piperidine-1,3-dicarboxylic acid O1-tert-butyl ester O3-[2-keto-2-(4-pyrrolidinosulfonylphenyl)ethyl] ester Formula: C23H32N2O7S MolecularWeight: 480.57438

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCCC(C1)C(=O)OCC(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCCC3

Isomeric SMILES

CC(C)(C)OC(=O)N1CCCC(C1)C(=O)OCC(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C23H32N2O7S/c1-23(2,3)32-22(28)24-12-6-7-18(15-24)21(27)31-16-20(26)17-8-10-19(11-9-17)33(29,30)25-13-4-5-14-25/h8-11,18H,4-7,12-16H2,1-3H3