N-[4-chloranyl-3-(trifluoromethyl)phenyl]-4-(4-methylpiperidin-1-yl)-3-nitro-benzamide

Systemtic Name: N-[4-chloranyl-3-(trifluoromethyl)phenyl]-4-(4-methylpiperidin-1-yl)-3-nitro-benzamide Openeye Name: N-[4-chloro-3-(trifluoromethyl)phenyl]-4-(4-methyl-1-piperidyl)-3-nitro-benzamide CAS Name: N-[4-chloro-3-(trifluoromethyl)phenyl]-4-(4-methyl-1-piperidinyl)-3-nitrobenzamide IUPAC Name: N-[4-chloro-3-(trifluoromethyl)phenyl]-4-(4-methylpiperidin-1-yl)-3-nitrobenzamide Traditional Name: N-[4-chloro-3-(trifluoromethyl)phenyl]-4-(4-methylpiperidino)-3-nitro-benzamide Formula: C20H19ClF3N3O3 MolecularWeight: 441.83137

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C2=C(C=C(C=C2)C(=O)NC3=CC(=C(C=C3)Cl)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

CC1CCN(CC1)C2=C(C=C(C=C2)C(=O)NC3=CC(=C(C=C3)Cl)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C20H19ClF3N3O3/c1-12-6-8-26(9-7-12)17-5-2-13(10-18(17)27(29)30)19(28)25-14-3-4-16(21)15(11-14)20(22,23)24/h2-5,10-12H,6-9H2,1H3,(H,25,28)