tert-butyl 4-(2-methyl-4-nitro-phenyl)piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-(2-methyl-4-nitro-phenyl)piperazine-1-carboxylate Openeye Name: tert-butyl 4-(2-methyl-4-nitro-phenyl)piperazine-1-carboxylate CAS Name: 4-(2-methyl-4-nitrophenyl)-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(2-methyl-4-nitrophenyl)piperazine-1-carboxylate Traditional Name: 4-(2-methyl-4-nitro-phenyl)piperazine-1-carboxylic acid tert-butyl ester Formula: C16H23N3O4 MolecularWeight: 321.37152

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)[N+](=O)[O-])N2CCN(CC2)C(=O)OC(C)(C)C

Isomeric SMILES

CC1=C(C=CC(=C1)[N+](=O)[O-])N2CCN(CC2)C(=O)OC(C)(C)C

InChI

InChI=1S/C16H23N3O4/c1-12-11-13(19(21)22)5-6-14(12)17-7-9-18(10-8-17)15(20)23-16(2,3)4/h5-6,11H,7-10H2,1-4H3