5-isocyano-4-[(4-methoxyphenyl)diazenyl]-2-phenyl-4H-pyrazol-3-one

Systemtic Name: 5-isocyano-4-[(4-methoxyphenyl)diazenyl]-2-phenyl-4H-pyrazol-3-one Openeye Name: 5-isocyano-4-(4-methoxyphenyl)azo-2-phenyl-4H-pyrazol-3-one CAS Name: 5-isocyano-4-(4-methoxyphenyl)azo-2-phenyl-4H-pyrazol-3-one IUPAC Name: 5-isocyano-4-[(4-methoxyphenyl)diazenyl]-2-phenyl-4H-pyrazol-3-one Traditional Name: 5-isocyano-4-(4-methoxyphenyl)azo-2-phenyl-2-pyrazolin-3-one Formula: C17H13N5O2 MolecularWeight: 319.31742

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N=NC2C(=NN(C2=O)C3=CC=CC=C3)[N+]#[C-]

Isomeric SMILES

COC1=CC=C(C=C1)N=NC2C(=NN(C2=O)C3=CC=CC=C3)[N+]#[C-]

InChI

InChI=1S/C17H13N5O2/c1-18-16-15(20-19-12-8-10-14(24-2)11-9-12)17(23)22(21-16)13-6-4-3-5-7-13/h3-11,15H,2H3