N-(benzotriazol-1-ylmethyl)-3-nitro-benzamide

Systemtic Name: N-(benzotriazol-1-ylmethyl)-3-nitro-benzamide Openeye Name: N-(benzotriazol-1-ylmethyl)-3-nitro-benzamide CAS Name: N-(1-benzotriazolylmethyl)-3-nitrobenzamide IUPAC Name: N-(benzotriazol-1-ylmethyl)-3-nitrobenzamide Traditional Name: N-(benzotriazol-1-ylmethyl)-3-nitro-benzamide Formula: C14H11N5O3 MolecularWeight: 297.26884

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=NN2CNC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)N=NN2CNC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C14H11N5O3/c20-14(10-4-3-5-11(8-10)19(21)22)15-9-18-13-7-2-1-6-12(13)16-17-18/h1-8H,9H2,(H,15,20)