tert-butyl 4-(4-methoxy-3-morpholin-4-ylsulfonyl-phenyl)carbonylpiperazine-1-carboxylate

Systemtic Name: tert-butyl 4-(4-methoxy-3-morpholin-4-ylsulfonyl-phenyl)carbonylpiperazine-1-carboxylate Openeye Name: tert-butyl 4-(4-methoxy-3-morpholinosulfonyl-benzoyl)piperazine-1-carboxylate CAS Name: 4-[[4-methoxy-3-(4-morpholinylsulfonyl)phenyl]-oxomethyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(4-methoxy-3-morpholin-4-ylsulfonylbenzoyl)piperazine-1-carboxylate Traditional Name: 4-(4-methoxy-3-morpholinosulfonyl-benzoyl)piperazine-1-carboxylic acid tert-butyl ester Formula: C21H31N3O7S MolecularWeight: 469.55174

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)C(=O)C2=CC(=C(C=C2)OC)S(=O)(=O)N3CCOCC3

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)C(=O)C2=CC(=C(C=C2)OC)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C21H31N3O7S/c1-21(2,3)31-20(26)23-9-7-22(8-10-23)19(25)16-5-6-17(29-4)18(15-16)32(27,28)24-11-13-30-14-12-24/h5-6,15H,7-14H2,1-4H3