4-phenyl-5-propyl-1,2,4-triazole-3-carbaldehyde

Systemtic Name: 4-phenyl-5-propyl-1,2,4-triazole-3-carbaldehyde Openeye Name: 4-phenyl-5-propyl-1,2,4-triazole-3-carbaldehyde CAS Name: 4-phenyl-5-propyl-1,2,4-triazole-3-carboxaldehyde IUPAC Name: 4-phenyl-5-propyl-1,2,4-triazole-3-carbaldehyde Traditional Name: 4-phenyl-5-propyl-1,2,4-triazole-3-carbaldehyde Formula: C12H13N3O MolecularWeight: 215.25112

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN=C(N1C2=CC=CC=C2)C=O

Isomeric SMILES

CCCC1=NN=C(N1C2=CC=CC=C2)C=O

InChI

InChI=1S/C12H13N3O/c1-2-6-11-13-14-12(9-16)15(11)10-7-4-3-5-8-10/h3-5,7-9H,2,6H2,1H3