(4-tert-butylphenyl)-[4-(2-nitrophenyl)piperazin-1-yl]methanone

Systemtic Name: (4-tert-butylphenyl)-[4-(2-nitrophenyl)piperazin-1-yl]methanone Openeye Name: (4-tert-butylphenyl)-[4-(2-nitrophenyl)piperazin-1-yl]methanone CAS Name: (4-tert-butylphenyl)-[4-(2-nitrophenyl)-1-piperazinyl]methanone IUPAC Name: (4-tert-butylphenyl)-[4-(2-nitrophenyl)piperazin-1-yl]methanone Traditional Name: (4-tert-butylphenyl)-[4-(2-nitrophenyl)piperazino]methanone Formula: C21H25N3O3 MolecularWeight: 367.4415

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H25N3O3/c1-21(2,3)17-10-8-16(9-11-17)20(25)23-14-12-22(13-15-23)18-6-4-5-7-19(18)24(26)27/h4-11H,12-15H2,1-3H3