N-(6-methyl-2-phenyl-benzotriazol-5-yl)-3,5-dinitro-benzamide

Systemtic Name: N-(6-methyl-2-phenyl-benzotriazol-5-yl)-3,5-dinitro-benzamide Openeye Name: N-(6-methyl-2-phenyl-benzotriazol-5-yl)-3,5-dinitro-benzamide CAS Name: N-(6-methyl-2-phenyl-5-benzotriazolyl)-3,5-dinitrobenzamide IUPAC Name: N-(6-methyl-2-phenylbenzotriazol-5-yl)-3,5-dinitrobenzamide Traditional Name: N-(6-methyl-2-phenyl-benzotriazol-5-yl)-3,5-dinitro-benzamide Formula: C20H14N6O5 MolecularWeight: 418.36236

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=NN(N=C2C=C1NC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-])C4=CC=CC=C4

Isomeric SMILES

CC1=CC2=NN(N=C2C=C1NC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-])C4=CC=CC=C4

InChI

InChI=1S/C20H14N6O5/c1-12-7-18-19(23-24(22-18)14-5-3-2-4-6-14)11-17(12)21-20(27)13-8-15(25(28)29)10-16(9-13)26(30)31/h2-11H,1H3,(H,21,27)