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

Systemtic Name: N-(4-benzo[e][1,3]benzoxazol-2-ylphenyl)-3-methyl-4-nitro-benzamide Openeye Name: N-(4-benzo[e][1,3]benzoxazol-2-ylphenyl)-3-methyl-4-nitro-benzamide CAS Name: N-[4-(2-benzo[e][1,3]benzoxazolyl)phenyl]-3-methyl-4-nitrobenzamide IUPAC Name: N-(4-benzo[e][1,3]benzoxazol-2-ylphenyl)-3-methyl-4-nitrobenzamide Traditional Name: N-(4-benzo[e][1,3]benzoxazol-2-ylphenyl)-3-methyl-4-nitro-benzamide Formula: C25H17N3O4 MolecularWeight: 423.42018

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)NC2=CC=C(C=C2)C3=NC4=C(O3)C=CC5=CC=CC=C54)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)NC2=CC=C(C=C2)C3=NC4=C(O3)C=CC5=CC=CC=C54)[N+](=O)[O-]

InChI

InChI=1S/C25H17N3O4/c1-15-14-18(8-12-21(15)28(30)31)24(29)26-19-10-6-17(7-11-19)25-27-23-20-5-3-2-4-16(20)9-13-22(23)32-25/h2-14H,1H3,(H,26,29)