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

Systemtic Name: N-[2-(4-butylphenyl)benzotriazol-5-yl]-2-nitro-benzamide Openeye Name: N-[2-(4-butylphenyl)benzotriazol-5-yl]-2-nitro-benzamide CAS Name: N-[2-(4-butylphenyl)-5-benzotriazolyl]-2-nitrobenzamide IUPAC Name: N-[2-(4-butylphenyl)benzotriazol-5-yl]-2-nitrobenzamide Traditional Name: N-[2-(4-butylphenyl)benzotriazol-5-yl]-2-nitro-benzamide Formula: C23H21N5O3 MolecularWeight: 415.44454

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H21N5O3/c1-2-3-6-16-9-12-18(13-10-16)27-25-20-14-11-17(15-21(20)26-27)24-23(29)19-7-4-5-8-22(19)28(30)31/h4-5,7-15H,2-3,6H2,1H3,(H,24,29)