N-[2-(3-fluorophenyl)ethyl]-2-nitro-4-pyrrolidin-1-ylsulfonyl-aniline

Systemtic Name: N-[2-(3-fluorophenyl)ethyl]-2-nitro-4-pyrrolidin-1-ylsulfonyl-aniline Openeye Name: N-[2-(3-fluorophenyl)ethyl]-2-nitro-4-pyrrolidin-1-ylsulfonyl-aniline CAS Name: N-[2-(3-fluorophenyl)ethyl]-2-nitro-4-(1-pyrrolidinylsulfonyl)aniline IUPAC Name: N-[2-(3-fluorophenyl)ethyl]-2-nitro-4-pyrrolidin-1-ylsulfonylaniline Traditional Name: 2-(3-fluorophenyl)ethyl-(2-nitro-4-pyrrolidinosulfonyl-phenyl)amine Formula: C18H20FN3O4S MolecularWeight: 393.432503

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)NCCC3=CC(=CC=C3)F)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)NCCC3=CC(=CC=C3)F)[N+](=O)[O-]

InChI

InChI=1S/C18H20FN3O4S/c19-15-5-3-4-14(12-15)8-9-20-17-7-6-16(13-18(17)22(23)24)27(25,26)21-10-1-2-11-21/h3-7,12-13,20H,1-2,8-11H2