N-[4-(phenylcarbamoyl)phenyl]-2-[(2,4,6-trinitrophenyl)amino]benzamide

Systemtic Name: N-[4-(phenylcarbamoyl)phenyl]-2-[(2,4,6-trinitrophenyl)amino]benzamide Openeye Name: N-[4-(phenylcarbamoyl)phenyl]-2-(2,4,6-trinitroanilino)benzamide CAS Name: N-[4-[anilino(oxo)methyl]phenyl]-2-(2,4,6-trinitroanilino)benzamide IUPAC Name: N-[4-(phenylcarbamoyl)phenyl]-2-(2,4,6-trinitroanilino)benzamide Traditional Name: N-[4-(phenylcarbamoyl)phenyl]-2-(2,4,6-trinitroanilino)benzamide Formula: C26H18N6O8 MolecularWeight: 542.45652

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)NC(=O)C3=CC=CC=C3NC4=C(C=C(C=C4[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)NC(=O)C3=CC=CC=C3NC4=C(C=C(C=C4[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C26H18N6O8/c33-25(27-17-6-2-1-3-7-17)16-10-12-18(13-11-16)28-26(34)20-8-4-5-9-21(20)29-24-22(31(37)38)14-19(30(35)36)15-23(24)32(39)40/h1-15,29H,(H,27,33)(H,28,34)