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N-[2-[(4-methylsulfonyl-2-nitro-phenyl)amino]ethyl]-3,5-bis(trifluoromethyl)benzamide

N-[2-[(4-methylsulfonyl-2-nitro-phenyl)amino]ethyl]-3,5-bis(trifluoromethyl)benzamide

Systemtic Name:N-[2-[(4-methylsulfonyl-2-nitro-phenyl)amino]ethyl]-3,5-bis(trifluoromethyl)benzamide
Openeye Name:N-[2-(4-methylsulfonyl-2-nitro-anilino)ethyl]-3,5-bis(trifluoromethyl)benzamide
CAS Name:N-[2-(4-methylsulfonyl-2-nitroanilino)ethyl]-3,5-bis(trifluoromethyl)benzamide
IUPAC Name:N-[2-(4-methylsulfonyl-2-nitroanilino)ethyl]-3,5-bis(trifluoromethyl)benzamide
Traditional Name:N-[2-(4-mesyl-2-nitro-anilino)ethyl]-3,5-bis(trifluoromethyl)benzamide
Formula: C18H15F6N3O5S
MolecularWeight: 499.384219
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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC(=C(C=C1)NCCNC(=O)C2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F)[N+](=O)[O-]


Isomeric SMILES

CS(=O)(=O)C1=CC(=C(C=C1)NCCNC(=O)C2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F)[N+](=O)[O-]


InChI

InChI=1S/C18H15F6N3O5S/c1-33(31,32)13-2-3-14(15(9-13)27(29)30)25-4-5-26-16(28)10-6-11(17(19,20)21)8-12(7-10)18(22,23)24/h2-3,6-9,25H,4-5H2,1H3,(H,26,28)


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