5-[4-(2,4-dinitrophenyl)piperazin-1-yl]-2-nitro-N-(4-phenylbutan-2-yl)aniline

Systemtic Name: 5-[4-(2,4-dinitrophenyl)piperazin-1-yl]-2-nitro-N-(4-phenylbutan-2-yl)aniline Openeye Name: 5-[4-(2,4-dinitrophenyl)piperazin-1-yl]-N-(1-methyl-3-phenyl-propyl)-2-nitro-aniline CAS Name: 5-[4-(2,4-dinitrophenyl)-1-piperazinyl]-2-nitro-N-(4-phenylbutan-2-yl)aniline IUPAC Name: 5-[4-(2,4-dinitrophenyl)piperazin-1-yl]-2-nitro-N-(4-phenylbutan-2-yl)aniline Traditional Name: [5-[4-(2,4-dinitrophenyl)piperazino]-2-nitro-phenyl]-(1-methyl-3-phenyl-propyl)amine Formula: C26H28N6O6 MolecularWeight: 520.53712

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC=CC=C1)NC2=C(C=CC(=C2)N3CCN(CC3)C4=C(C=C(C=C4)[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC(CCC1=CC=CC=C1)NC2=C(C=CC(=C2)N3CCN(CC3)C4=C(C=C(C=C4)[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C26H28N6O6/c1-19(7-8-20-5-3-2-4-6-20)27-23-17-21(9-11-24(23)31(35)36)28-13-15-29(16-14-28)25-12-10-22(30(33)34)18-26(25)32(37)38/h2-6,9-12,17-19,27H,7-8,13-16H2,1H3