[4-(2,4-dimethylphenyl)piperazin-1-yl]-(3-nitrophenyl)methanone

Systemtic Name: [4-(2,4-dimethylphenyl)piperazin-1-yl]-(3-nitrophenyl)methanone Openeye Name: [4-(2,4-dimethylphenyl)piperazin-1-yl]-(3-nitrophenyl)methanone CAS Name: [4-(2,4-dimethylphenyl)-1-piperazinyl]-(3-nitrophenyl)methanone IUPAC Name: [4-(2,4-dimethylphenyl)piperazin-1-yl]-(3-nitrophenyl)methanone Traditional Name: [4-(2,4-dimethylphenyl)piperazino]-(3-nitrophenyl)methanone Formula: C19H21N3O3 MolecularWeight: 339.38834

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H21N3O3/c1-14-6-7-18(15(2)12-14)20-8-10-21(11-9-20)19(23)16-4-3-5-17(13-16)22(24)25/h3-7,12-13H,8-11H2,1-2H3