ethyl 4-(3-tert-butyl-4-ethoxy-phenyl)sulfonylpiperazine-1-carboxylate

Systemtic Name: ethyl 4-(3-tert-butyl-4-ethoxy-phenyl)sulfonylpiperazine-1-carboxylate Openeye Name: ethyl 4-(3-tert-butyl-4-ethoxy-phenyl)sulfonylpiperazine-1-carboxylate CAS Name: 4-(3-tert-butyl-4-ethoxyphenyl)sulfonyl-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(3-tert-butyl-4-ethoxyphenyl)sulfonylpiperazine-1-carboxylate Traditional Name: 4-(3-tert-butyl-4-ethoxy-phenyl)sulfonylpiperazine-1-carboxylic acid ethyl ester Formula: C19H30N2O5S MolecularWeight: 398.5169

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)OCC)C(C)(C)C

Isomeric SMILES

CCOC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)OCC)C(C)(C)C

InChI

InChI=1S/C19H30N2O5S/c1-6-25-17-9-8-15(14-16(17)19(3,4)5)27(23,24)21-12-10-20(11-13-21)18(22)26-7-2/h8-9,14H,6-7,10-13H2,1-5H3