3-(4-dimethylaminophenyl)-4-nitro-1-phenyl-butan-1-one

Systemtic Name: 3-(4-dimethylaminophenyl)-4-nitro-1-phenyl-butan-1-one Openeye Name: 3-(4-dimethylaminophenyl)-4-nitro-1-phenyl-butan-1-one CAS Name: 3-(4-dimethylaminophenyl)-4-nitro-1-phenyl-1-butanone IUPAC Name: 3-(4-dimethylaminophenyl)-4-nitro-1-phenylbutan-1-one Traditional Name: 3-(4-dimethylaminophenyl)-4-nitro-1-phenyl-butan-1-one Formula: C18H20N2O3 MolecularWeight: 312.363

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C(CC(=O)C2=CC=CC=C2)C[N+](=O)[O-]

Isomeric SMILES

CN(C)C1=CC=C(C=C1)C(CC(=O)C2=CC=CC=C2)C[N+](=O)[O-]

InChI

InChI=1S/C18H20N2O3/c1-19(2)17-10-8-14(9-11-17)16(13-20(22)23)12-18(21)15-6-4-3-5-7-15/h3-11,16H,12-13H2,1-2H3