N-[(2R)-2-(4-fluorophenyl)-2-morpholin-4-yl-ethyl]-2-nitro-4-pyrrolidin-1-ylsulfonyl-aniline

Systemtic Name: N-[(2R)-2-(4-fluorophenyl)-2-morpholin-4-yl-ethyl]-2-nitro-4-pyrrolidin-1-ylsulfonyl-aniline Openeye Name: N-[(2R)-2-(4-fluorophenyl)-2-morpholino-ethyl]-2-nitro-4-pyrrolidin-1-ylsulfonyl-aniline CAS Name: N-[(2R)-2-(4-fluorophenyl)-2-(4-morpholinyl)ethyl]-2-nitro-4-(1-pyrrolidinylsulfonyl)aniline IUPAC Name: N-[(2R)-2-(4-fluorophenyl)-2-morpholin-4-ylethyl]-2-nitro-4-pyrrolidin-1-ylsulfonylaniline Traditional Name: [(2R)-2-(4-fluorophenyl)-2-morpholino-ethyl]-(2-nitro-4-pyrrolidinosulfonyl-phenyl)amine Formula: C22H27FN4O5S MolecularWeight: 478.536983

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)NCC(C3=CC=C(C=C3)F)N4CCOCC4)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)NC[C@@H](C3=CC=C(C=C3)F)N4CCOCC4)[N+](=O)[O-]

InChI

InChI=1S/C22H27FN4O5S/c23-18-5-3-17(4-6-18)22(25-11-13-32-14-12-25)16-24-20-8-7-19(15-21(20)27(28)29)33(30,31)26-9-1-2-10-26/h3-8,15,22,24H,1-2,9-14,16H2/t22-/m0/s1