[2-[5-ethyl-2-(hydroxymethyl)-4-methyl-imidazol-1-yl]-5-nitro-phenyl]-phenyl-methanone

Systemtic Name: [2-[5-ethyl-2-(hydroxymethyl)-4-methyl-imidazol-1-yl]-5-nitro-phenyl]-phenyl-methanone Openeye Name: [2-[5-ethyl-2-(hydroxymethyl)-4-methyl-imidazol-1-yl]-5-nitro-phenyl]-phenyl-methanone CAS Name: [2-[5-ethyl-2-(hydroxymethyl)-4-methyl-1-imidazolyl]-5-nitrophenyl]-phenylmethanone IUPAC Name: [2-[5-ethyl-2-(hydroxymethyl)-4-methylimidazol-1-yl]-5-nitrophenyl]-phenylmethanone Traditional Name: [2-(5-ethyl-4-methyl-2-methylol-imidazol-1-yl)-5-nitro-phenyl]-phenyl-methanone Formula: C20H19N3O4 MolecularWeight: 365.38256

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N=C(N1C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)C3=CC=CC=C3)CO)C

Isomeric SMILES

CCC1=C(N=C(N1C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)C3=CC=CC=C3)CO)C

InChI

InChI=1S/C20H19N3O4/c1-3-17-13(2)21-19(12-24)22(17)18-10-9-15(23(26)27)11-16(18)20(25)14-7-5-4-6-8-14/h4-11,24H,3,12H2,1-2H3