2-[[4-(2,5-dimethylphenyl)piperazin-1-yl]methyl]-4-nitro-phenol

Systemtic Name: 2-[[4-(2,5-dimethylphenyl)piperazin-1-yl]methyl]-4-nitro-phenol Openeye Name: 2-[[4-(2,5-dimethylphenyl)piperazin-1-yl]methyl]-4-nitro-phenol CAS Name: 2-[[4-(2,5-dimethylphenyl)-1-piperazinyl]methyl]-4-nitrophenol IUPAC Name: 2-[[4-(2,5-dimethylphenyl)piperazin-1-yl]methyl]-4-nitrophenol Traditional Name: 2-[[4-(2,5-dimethylphenyl)piperazino]methyl]-4-nitro-phenol Formula: C19H23N3O3 MolecularWeight: 341.40422

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)N2CCN(CC2)CC3=C(C=CC(=C3)[N+](=O)[O-])O

Isomeric SMILES

CC1=CC(=C(C=C1)C)N2CCN(CC2)CC3=C(C=CC(=C3)[N+](=O)[O-])O

InChI

InChI=1S/C19H23N3O3/c1-14-3-4-15(2)18(11-14)21-9-7-20(8-10-21)13-16-12-17(22(24)25)5-6-19(16)23/h3-6,11-12,23H,7-10,13H2,1-2H3