N-(2-tert-butyl-6-methyl-phenyl)-4-(4-nitrophenyl)piperazine-1-carboxamide

Systemtic Name: N-(2-tert-butyl-6-methyl-phenyl)-4-(4-nitrophenyl)piperazine-1-carboxamide Openeye Name: N-(2-tert-butyl-6-methyl-phenyl)-4-(4-nitrophenyl)piperazine-1-carboxamide CAS Name: N-(2-tert-butyl-6-methylphenyl)-4-(4-nitrophenyl)-1-piperazinecarboxamide IUPAC Name: N-(2-tert-butyl-6-methylphenyl)-4-(4-nitrophenyl)piperazine-1-carboxamide Traditional Name: N-(2-tert-butyl-6-methyl-phenyl)-4-(4-nitrophenyl)piperazine-1-carboxamide Formula: C22H28N4O3 MolecularWeight: 396.48272

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C(C)(C)C)NC(=O)N2CCN(CC2)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=CC=C1)C(C)(C)C)NC(=O)N2CCN(CC2)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C22H28N4O3/c1-16-6-5-7-19(22(2,3)4)20(16)23-21(27)25-14-12-24(13-15-25)17-8-10-18(11-9-17)26(28)29/h5-11H,12-15H2,1-4H3,(H,23,27)