N-[2-(cyclohexen-1-yl)ethyl]-2-nitro-4-(trifluoromethylsulfonyl)aniline

Systemtic Name: N-[2-(cyclohexen-1-yl)ethyl]-2-nitro-4-(trifluoromethylsulfonyl)aniline Openeye Name: N-[2-(cyclohexen-1-yl)ethyl]-2-nitro-4-(trifluoromethylsulfonyl)aniline CAS Name: N-[2-(1-cyclohexenyl)ethyl]-2-nitro-4-(trifluoromethylsulfonyl)aniline IUPAC Name: N-[2-(cyclohexen-1-yl)ethyl]-2-nitro-4-(trifluoromethylsulfonyl)aniline Traditional Name: 2-(cyclohexen-1-yl)ethyl-(2-nitro-4-triflyl-phenyl)amine Formula: C15H17F3N2O4S MolecularWeight: 378.36669

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=CC1)CCNC2=C(C=C(C=C2)S(=O)(=O)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

C1CCC(=CC1)CCNC2=C(C=C(C=C2)S(=O)(=O)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C15H17F3N2O4S/c16-15(17,18)25(23,24)12-6-7-13(14(10-12)20(21)22)19-9-8-11-4-2-1-3-5-11/h4,6-7,10,19H,1-3,5,8-9H2