3-fluoranyl-4-methyl-N-(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenyl)aniline

Systemtic Name: 3-fluoranyl-4-methyl-N-(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenyl)aniline Openeye Name: 3-fluoro-4-methyl-N-(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenyl)aniline CAS Name: 3-fluoro-4-methyl-N-[2-nitro-4-(1-pyrrolidinylsulfonyl)phenyl]aniline IUPAC Name: 3-fluoro-4-methyl-N-(2-nitro-4-pyrrolidin-1-ylsulfonylphenyl)aniline Traditional Name: (3-fluoro-4-methyl-phenyl)-(2-nitro-4-pyrrolidinosulfonyl-phenyl)amine Formula: C17H18FN3O4S MolecularWeight: 379.405923

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC2=C(C=C(C=C2)S(=O)(=O)N3CCCC3)[N+](=O)[O-])F

Isomeric SMILES

CC1=C(C=C(C=C1)NC2=C(C=C(C=C2)S(=O)(=O)N3CCCC3)[N+](=O)[O-])F

InChI

InChI=1S/C17H18FN3O4S/c1-12-4-5-13(10-15(12)18)19-16-7-6-14(11-17(16)21(22)23)26(24,25)20-8-2-3-9-20/h4-7,10-11,19H,2-3,8-9H2,1H3