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

Systemtic Name: N-[4-(cyclopropylcarbonylamino)-2-(trifluoromethyl)phenyl]-2-methyl-3-nitro-benzamide Openeye Name: N-[4-(cyclopropanecarbonylamino)-2-(trifluoromethyl)phenyl]-2-methyl-3-nitro-benzamide CAS Name: N-[4-[[cyclopropyl(oxo)methyl]amino]-2-(trifluoromethyl)phenyl]-2-methyl-3-nitrobenzamide IUPAC Name: N-[4-(cyclopropanecarbonylamino)-2-(trifluoromethyl)phenyl]-2-methyl-3-nitrobenzamide Traditional Name: N-[4-(cyclopropanecarbonylamino)-2-(trifluoromethyl)phenyl]-2-methyl-3-nitro-benzamide Formula: C19H16F3N3O4 MolecularWeight: 407.34325

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1[N+](=O)[O-])C(=O)NC2=C(C=C(C=C2)NC(=O)C3CC3)C(F)(F)F

Isomeric SMILES

CC1=C(C=CC=C1[N+](=O)[O-])C(=O)NC2=C(C=C(C=C2)NC(=O)C3CC3)C(F)(F)F

InChI

InChI=1S/C19H16F3N3O4/c1-10-13(3-2-4-16(10)25(28)29)18(27)24-15-8-7-12(9-14(15)19(20,21)22)23-17(26)11-5-6-11/h2-4,7-9,11H,5-6H2,1H3,(H,23,26)(H,24,27)