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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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