N-(2-benzo[e][1,3]benzoxazol-2-ylphenyl)-4-methyl-3,5-dinitro-benzamide

Systemtic Name: N-(2-benzo[e][1,3]benzoxazol-2-ylphenyl)-4-methyl-3,5-dinitro-benzamide Openeye Name: N-(2-benzo[e][1,3]benzoxazol-2-ylphenyl)-4-methyl-3,5-dinitro-benzamide CAS Name: N-[2-(2-benzo[e][1,3]benzoxazolyl)phenyl]-4-methyl-3,5-dinitrobenzamide IUPAC Name: N-(2-benzo[e][1,3]benzoxazol-2-ylphenyl)-4-methyl-3,5-dinitrobenzamide Traditional Name: N-(2-benzo[e][1,3]benzoxazol-2-ylphenyl)-4-methyl-3,5-dinitro-benzamide Formula: C25H16N4O6 MolecularWeight: 468.41774

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1[N+](=O)[O-])C(=O)NC2=CC=CC=C2C3=NC4=C(O3)C=CC5=CC=CC=C54)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1[N+](=O)[O-])C(=O)NC2=CC=CC=C2C3=NC4=C(O3)C=CC5=CC=CC=C54)[N+](=O)[O-]

InChI

InChI=1S/C25H16N4O6/c1-14-20(28(31)32)12-16(13-21(14)29(33)34)24(30)26-19-9-5-4-8-18(19)25-27-23-17-7-3-2-6-15(17)10-11-22(23)35-25/h2-13H,1H3,(H,26,30)