tert-butyl 4-(3-cyanophenyl)sulfonylpiperazine-1-carboxylate

Systemtic Name: tert-butyl 4-(3-cyanophenyl)sulfonylpiperazine-1-carboxylate Openeye Name: tert-butyl 4-(3-cyanophenyl)sulfonylpiperazine-1-carboxylate CAS Name: 4-(3-cyanophenyl)sulfonyl-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(3-cyanophenyl)sulfonylpiperazine-1-carboxylate Traditional Name: 4-(3-cyanophenyl)sulfonylpiperazine-1-carboxylic acid tert-butyl ester Formula: C16H21N3O4S MolecularWeight: 351.42064

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C#N

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C#N

InChI

InChI=1S/C16H21N3O4S/c1-16(2,3)23-15(20)18-7-9-19(10-8-18)24(21,22)14-6-4-5-13(11-14)12-17/h4-6,11H,7-10H2,1-3H3