N-[(3-fluoranyl-4-methyl-phenyl)methyl]-2-morpholin-4-ylsulfonyl-4-nitro-aniline

Systemtic Name: N-[(3-fluoranyl-4-methyl-phenyl)methyl]-2-morpholin-4-ylsulfonyl-4-nitro-aniline Openeye Name: N-[(3-fluoro-4-methyl-phenyl)methyl]-2-morpholinosulfonyl-4-nitro-aniline CAS Name: N-[(3-fluoro-4-methylphenyl)methyl]-2-(4-morpholinylsulfonyl)-4-nitroaniline IUPAC Name: N-[(3-fluoro-4-methylphenyl)methyl]-2-morpholin-4-ylsulfonyl-4-nitroaniline Traditional Name: (3-fluoro-4-methyl-benzyl)-(2-morpholinosulfonyl-4-nitro-phenyl)amine Formula: C18H20FN3O5S MolecularWeight: 409.431903

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)CNC2=C(C=C(C=C2)[N+](=O)[O-])S(=O)(=O)N3CCOCC3)F

Isomeric SMILES

CC1=C(C=C(C=C1)CNC2=C(C=C(C=C2)[N+](=O)[O-])S(=O)(=O)N3CCOCC3)F

InChI

InChI=1S/C18H20FN3O5S/c1-13-2-3-14(10-16(13)19)12-20-17-5-4-15(22(23)24)11-18(17)28(25,26)21-6-8-27-9-7-21/h2-5,10-11,20H,6-9,12H2,1H3