tert-butyl 4-(3,4-dimethylphenyl)sulfonylpiperazine-1-carboxylate

Systemtic Name: tert-butyl 4-(3,4-dimethylphenyl)sulfonylpiperazine-1-carboxylate Openeye Name: tert-butyl 4-(3,4-dimethylphenyl)sulfonylpiperazine-1-carboxylate CAS Name: 4-(3,4-dimethylphenyl)sulfonyl-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(3,4-dimethylphenyl)sulfonylpiperazine-1-carboxylate Traditional Name: 4-(3,4-dimethylphenyl)sulfonylpiperazine-1-carboxylic acid tert-butyl ester Formula: C17H26N2O4S MolecularWeight: 354.46434

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)OC(C)(C)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)OC(C)(C)C)C

InChI

InChI=1S/C17H26N2O4S/c1-13-6-7-15(12-14(13)2)24(21,22)19-10-8-18(9-11-19)16(20)23-17(3,4)5/h6-7,12H,8-11H2,1-5H3