4-bromanyl-N-[4-(cyclopropylcarbonylamino)-2-(trifluoromethyl)phenyl]-3-nitro-benzamide

Systemtic Name: 4-bromanyl-N-[4-(cyclopropylcarbonylamino)-2-(trifluoromethyl)phenyl]-3-nitro-benzamide Openeye Name: 4-bromo-N-[4-(cyclopropanecarbonylamino)-2-(trifluoromethyl)phenyl]-3-nitro-benzamide CAS Name: 4-bromo-N-[4-[[cyclopropyl(oxo)methyl]amino]-2-(trifluoromethyl)phenyl]-3-nitrobenzamide IUPAC Name: 4-bromo-N-[4-(cyclopropanecarbonylamino)-2-(trifluoromethyl)phenyl]-3-nitrobenzamide Traditional Name: 4-bromo-N-[4-(cyclopropanecarbonylamino)-2-(trifluoromethyl)phenyl]-3-nitro-benzamide Formula: C18H13BrF3N3O4 MolecularWeight: 472.21273

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC1C(=O)NC2=CC(=C(C=C2)NC(=O)C3=CC(=C(C=C3)Br)[N+](=O)[O-])C(F)(F)F

Isomeric SMILES

C1CC1C(=O)NC2=CC(=C(C=C2)NC(=O)C3=CC(=C(C=C3)Br)[N+](=O)[O-])C(F)(F)F

InChI

InChI=1S/C18H13BrF3N3O4/c19-13-5-3-10(7-15(13)25(28)29)17(27)24-14-6-4-11(8-12(14)18(20,21)22)23-16(26)9-1-2-9/h3-9H,1-2H2,(H,23,26)(H,24,27)