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

Systemtic Name: N-[(2-fluorophenyl)methyl]-4-nitro-2-pyrrolidin-1-ylsulfonyl-aniline Openeye Name: N-[(2-fluorophenyl)methyl]-4-nitro-2-pyrrolidin-1-ylsulfonyl-aniline CAS Name: N-[(2-fluorophenyl)methyl]-4-nitro-2-(1-pyrrolidinylsulfonyl)aniline IUPAC Name: N-[(2-fluorophenyl)methyl]-4-nitro-2-pyrrolidin-1-ylsulfonylaniline Traditional Name: (2-fluorobenzyl)-(4-nitro-2-pyrrolidinosulfonyl-phenyl)amine Formula: C17H18FN3O4S MolecularWeight: 379.405923

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=C(C=CC(=C2)[N+](=O)[O-])NCC3=CC=CC=C3F

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=C(C=CC(=C2)[N+](=O)[O-])NCC3=CC=CC=C3F

InChI

InChI=1S/C17H18FN3O4S/c18-15-6-2-1-5-13(15)12-19-16-8-7-14(21(22)23)11-17(16)26(24,25)20-9-3-4-10-20/h1-2,5-8,11,19H,3-4,9-10,12H2