tert-butyl 4-(5-methyl-4-nitro-thiophen-2-yl)carbonylpiperazine-1-carboxylate

Systemtic Name: tert-butyl 4-(5-methyl-4-nitro-thiophen-2-yl)carbonylpiperazine-1-carboxylate Openeye Name: tert-butyl 4-(5-methyl-4-nitro-thiophene-2-carbonyl)piperazine-1-carboxylate CAS Name: 4-[(5-methyl-4-nitro-2-thiophenyl)-oxomethyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(5-methyl-4-nitrothiophene-2-carbonyl)piperazine-1-carboxylate Traditional Name: 4-(5-methyl-4-nitro-thiophene-2-carbonyl)piperazine-1-carboxylic acid tert-butyl ester Formula: C15H21N3O5S MolecularWeight: 355.40934

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(S1)C(=O)N2CCN(CC2)C(=O)OC(C)(C)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(S1)C(=O)N2CCN(CC2)C(=O)OC(C)(C)C)[N+](=O)[O-]

InChI

InChI=1S/C15H21N3O5S/c1-10-11(18(21)22)9-12(24-10)13(19)16-5-7-17(8-6-16)14(20)23-15(2,3)4/h9H,5-8H2,1-4H3