N-[(2-fluorophenyl)methyl]-N-methyl-4-nitro-2-pyrrolidin-1-ylsulfonyl-aniline

Systemtic Name: N-[(2-fluorophenyl)methyl]-N-methyl-4-nitro-2-pyrrolidin-1-ylsulfonyl-aniline Openeye Name: N-[(2-fluorophenyl)methyl]-N-methyl-4-nitro-2-pyrrolidin-1-ylsulfonyl-aniline CAS Name: N-[(2-fluorophenyl)methyl]-N-methyl-4-nitro-2-(1-pyrrolidinylsulfonyl)aniline IUPAC Name: N-[(2-fluorophenyl)methyl]-N-methyl-4-nitro-2-pyrrolidin-1-ylsulfonylaniline Traditional Name: (2-fluorobenzyl)-methyl-(4-nitro-2-pyrrolidinosulfonyl-phenyl)amine Formula: C18H20FN3O4S MolecularWeight: 393.432503

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=C1F)C2=C(C=C(C=C2)[N+](=O)[O-])S(=O)(=O)N3CCCC3

Isomeric SMILES

CN(CC1=CC=CC=C1F)C2=C(C=C(C=C2)[N+](=O)[O-])S(=O)(=O)N3CCCC3

InChI

InChI=1S/C18H20FN3O4S/c1-20(13-14-6-2-3-7-16(14)19)17-9-8-15(22(23)24)12-18(17)27(25,26)21-10-4-5-11-21/h2-3,6-9,12H,4-5,10-11,13H2,1H3