tert-butyl 4-(4-pentylphenyl)sulfonylpiperazine-1-carboxylate

Systemtic Name: tert-butyl 4-(4-pentylphenyl)sulfonylpiperazine-1-carboxylate Openeye Name: tert-butyl 4-(4-pentylphenyl)sulfonylpiperazine-1-carboxylate CAS Name: 4-(4-pentylphenyl)sulfonyl-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(4-pentylphenyl)sulfonylpiperazine-1-carboxylate Traditional Name: 4-(4-amylphenyl)sulfonylpiperazine-1-carboxylic acid tert-butyl ester Formula: C20H32N2O4S MolecularWeight: 396.54408

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)OC(C)(C)C

Isomeric SMILES

CCCCCC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)OC(C)(C)C

InChI

InChI=1S/C20H32N2O4S/c1-5-6-7-8-17-9-11-18(12-10-17)27(24,25)22-15-13-21(14-16-22)19(23)26-20(2,3)4/h9-12H,5-8,13-16H2,1-4H3