tert-butyl 4-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]carbonylpiperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]carbonylpiperidine-1-carboxylate Openeye Name: tert-butyl 4-[4-(2,5-dimethylphenyl)sulfonylpiperazine-1-carbonyl]piperidine-1-carboxylate CAS Name: 4-[[4-(2,5-dimethylphenyl)sulfonyl-1-piperazinyl]-oxomethyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[4-(2,5-dimethylphenyl)sulfonylpiperazine-1-carbonyl]piperidine-1-carboxylate Traditional Name: 4-[4-(2,5-dimethylphenyl)sulfonylpiperazine-1-carbonyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C23H35N3O5S MolecularWeight: 465.6061

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)S(=O)(=O)N2CCN(CC2)C(=O)C3CCN(CC3)C(=O)OC(C)(C)C

Isomeric SMILES

CC1=CC(=C(C=C1)C)S(=O)(=O)N2CCN(CC2)C(=O)C3CCN(CC3)C(=O)OC(C)(C)C

InChI

InChI=1S/C23H35N3O5S/c1-17-6-7-18(2)20(16-17)32(29,30)26-14-12-24(13-15-26)21(27)19-8-10-25(11-9-19)22(28)31-23(3,4)5/h6-7,16,19H,8-15H2,1-5H3