N-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-N-methyl-2-nitro-4-pyrrolidin-1-ylsulfonyl-aniline

Systemtic Name: N-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-N-methyl-2-nitro-4-pyrrolidin-1-ylsulfonyl-aniline Openeye Name: N-[(2-chloro-6-fluoro-phenyl)methyl]-N-methyl-2-nitro-4-pyrrolidin-1-ylsulfonyl-aniline CAS Name: N-[(2-chloro-6-fluorophenyl)methyl]-N-methyl-2-nitro-4-(1-pyrrolidinylsulfonyl)aniline IUPAC Name: N-[(2-chloro-6-fluorophenyl)methyl]-N-methyl-2-nitro-4-pyrrolidin-1-ylsulfonylaniline Traditional Name: (2-chloro-6-fluoro-benzyl)-methyl-(2-nitro-4-pyrrolidinosulfonyl-phenyl)amine Formula: C18H19ClFN3O4S MolecularWeight: 427.877563

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=C(C=CC=C1Cl)F)C2=C(C=C(C=C2)S(=O)(=O)N3CCCC3)[N+](=O)[O-]

Isomeric SMILES

CN(CC1=C(C=CC=C1Cl)F)C2=C(C=C(C=C2)S(=O)(=O)N3CCCC3)[N+](=O)[O-]

InChI

InChI=1S/C18H19ClFN3O4S/c1-21(12-14-15(19)5-4-6-16(14)20)17-8-7-13(11-18(17)23(24)25)28(26,27)22-9-2-3-10-22/h4-8,11H,2-3,9-10,12H2,1H3