N-(4,5-diphenyl-1,2,3-triazol-1-yl)-4-nitro-benzamide

Systemtic Name: N-(4,5-diphenyl-1,2,3-triazol-1-yl)-4-nitro-benzamide Openeye Name: N-(4,5-diphenyltriazol-1-yl)-4-nitro-benzamide CAS Name: N-(4,5-diphenyl-1-triazolyl)-4-nitrobenzamide IUPAC Name: N-(4,5-diphenyltriazol-1-yl)-4-nitrobenzamide Traditional Name: N-(4,5-diphenyltriazol-1-yl)-4-nitro-benzamide Formula: C21H15N5O3 MolecularWeight: 385.3755

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(N(N=N2)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-])C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C2=C(N(N=N2)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-])C4=CC=CC=C4

InChI

InChI=1S/C21H15N5O3/c27-21(17-11-13-18(14-12-17)26(28)29)23-25-20(16-9-5-2-6-10-16)19(22-24-25)15-7-3-1-4-8-15/h1-14H,(H,23,27)