tert-butyl 4-(5-nitrothiophen-3-yl)carbonylpiperazine-1-carboxylate

Systemtic Name: tert-butyl 4-(5-nitrothiophen-3-yl)carbonylpiperazine-1-carboxylate Openeye Name: tert-butyl 4-(5-nitrothiophene-3-carbonyl)piperazine-1-carboxylate CAS Name: 4-[(5-nitro-3-thiophenyl)-oxomethyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(5-nitrothiophene-3-carbonyl)piperazine-1-carboxylate Traditional Name: 4-(5-nitrothiophene-3-carbonyl)piperazine-1-carboxylic acid tert-butyl ester Formula: C14H19N3O5S MolecularWeight: 341.38276

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)C(=O)C2=CSC(=C2)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)C(=O)C2=CSC(=C2)[N+](=O)[O-]

InChI

InChI=1S/C14H19N3O5S/c1-14(2,3)22-13(19)16-6-4-15(5-7-16)12(18)10-8-11(17(20)21)23-9-10/h8-9H,4-7H2,1-3H3