N-[2-(4-butylphenyl)-6-chloranyl-benzotriazol-5-yl]-4-nitro-benzamide

Systemtic Name: N-[2-(4-butylphenyl)-6-chloranyl-benzotriazol-5-yl]-4-nitro-benzamide Openeye Name: N-[2-(4-butylphenyl)-6-chloro-benzotriazol-5-yl]-4-nitro-benzamide CAS Name: N-[2-(4-butylphenyl)-6-chloro-5-benzotriazolyl]-4-nitrobenzamide IUPAC Name: N-[2-(4-butylphenyl)-6-chlorobenzotriazol-5-yl]-4-nitrobenzamide Traditional Name: N-[2-(4-butylphenyl)-6-chloro-benzotriazol-5-yl]-4-nitro-benzamide Formula: C23H20ClN5O3 MolecularWeight: 449.8896

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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