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

Systemtic Name: N-[2-(4-ethylphenyl)benzotriazol-5-yl]-4-nitro-benzamide Openeye Name: N-[2-(4-ethylphenyl)benzotriazol-5-yl]-4-nitro-benzamide CAS Name: N-[2-(4-ethylphenyl)-5-benzotriazolyl]-4-nitrobenzamide IUPAC Name: N-[2-(4-ethylphenyl)benzotriazol-5-yl]-4-nitrobenzamide Traditional Name: N-[2-(4-ethylphenyl)benzotriazol-5-yl]-4-nitro-benzamide Formula: C21H17N5O3 MolecularWeight: 387.39138

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)N2N=C3C=CC(=CC3=N2)NC(=O)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CCC1=CC=C(C=C1)N2N=C3C=CC(=CC3=N2)NC(=O)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H17N5O3/c1-2-14-3-8-17(9-4-14)25-23-19-12-7-16(13-20(19)24-25)22-21(27)15-5-10-18(11-6-15)26(28)29/h3-13H,2H2,1H3,(H,22,27)