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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)NCC3=CC=C(C=C3)F)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)NCC3=CC=C(C=C3)F)[N+](=O)[O-]

InChI

InChI=1S/C17H18FN3O4S/c18-14-5-3-13(4-6-14)12-19-16-8-7-15(11-17(16)21(22)23)26(24,25)20-9-1-2-10-20/h3-8,11,19H,1-2,9-10,12H2