3-(4-dimethylaminophenyl)-1-(4-methoxyphenyl)-4-methyl-4-nitro-pentan-1-one

Systemtic Name: 3-(4-dimethylaminophenyl)-1-(4-methoxyphenyl)-4-methyl-4-nitro-pentan-1-one Openeye Name: 3-(4-dimethylaminophenyl)-1-(4-methoxyphenyl)-4-methyl-4-nitro-pentan-1-one CAS Name: 3-(4-dimethylaminophenyl)-1-(4-methoxyphenyl)-4-methyl-4-nitro-1-pentanone IUPAC Name: 3-(4-dimethylaminophenyl)-1-(4-methoxyphenyl)-4-methyl-4-nitropentan-1-one Traditional Name: 3-(4-dimethylaminophenyl)-1-(4-methoxyphenyl)-4-methyl-4-nitro-pentan-1-one Formula: C21H26N2O4 MolecularWeight: 370.44214

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H26N2O4/c1-21(2,23(25)26)19(15-6-10-17(11-7-15)22(3)4)14-20(24)16-8-12-18(27-5)13-9-16/h6-13,19H,14H2,1-5H3