N-[2-(4-butylphenyl)benzotriazol-5-yl]-4-chloranyl-3-nitro-benzamide

Systemtic Name: N-[2-(4-butylphenyl)benzotriazol-5-yl]-4-chloranyl-3-nitro-benzamide Openeye Name: N-[2-(4-butylphenyl)benzotriazol-5-yl]-4-chloro-3-nitro-benzamide CAS Name: N-[2-(4-butylphenyl)-5-benzotriazolyl]-4-chloro-3-nitrobenzamide IUPAC Name: N-[2-(4-butylphenyl)benzotriazol-5-yl]-4-chloro-3-nitrobenzamide Traditional Name: N-[2-(4-butylphenyl)benzotriazol-5-yl]-4-chloro-3-nitro-benzamide Formula: C23H20ClN5O3 MolecularWeight: 449.8896

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)N2N=C3C=CC(=CC3=N2)NC(=O)C4=CC(=C(C=C4)Cl)[N+](=O)[O-]

Isomeric SMILES

CCCCC1=CC=C(C=C1)N2N=C3C=CC(=CC3=N2)NC(=O)C4=CC(=C(C=C4)Cl)[N+](=O)[O-]

InChI

InChI=1S/C23H20ClN5O3/c1-2-3-4-15-5-9-18(10-6-15)28-26-20-12-8-17(14-21(20)27-28)25-23(30)16-7-11-19(24)22(13-16)29(31)32/h5-14H,2-4H2,1H3,(H,25,30)