1-(2,6-dimethyl-3-nitro-phenyl)pyrrole-2-carbaldehyde

Systemtic Name: 1-(2,6-dimethyl-3-nitro-phenyl)pyrrole-2-carbaldehyde Openeye Name: 1-(2,6-dimethyl-3-nitro-phenyl)pyrrole-2-carbaldehyde CAS Name: 1-(2,6-dimethyl-3-nitrophenyl)-2-pyrrolecarboxaldehyde IUPAC Name: 1-(2,6-dimethyl-3-nitrophenyl)pyrrole-2-carbaldehyde Traditional Name: 1-(2,6-dimethyl-3-nitro-phenyl)pyrrole-2-carbaldehyde Formula: C13H12N2O3 MolecularWeight: 244.24598

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)[N+](=O)[O-])C)N2C=CC=C2C=O

Isomeric SMILES

CC1=C(C(=C(C=C1)[N+](=O)[O-])C)N2C=CC=C2C=O

InChI

InChI=1S/C13H12N2O3/c1-9-5-6-12(15(17)18)10(2)13(9)14-7-3-4-11(14)8-16/h3-8H,1-2H3