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

Systemtic Name: N-[(E)-(2-chloranyl-6-fluoranyl-phenyl)methylideneamino]-2-nitro-4-pyrrolidin-1-ylsulfonyl-aniline Openeye Name: N-[(E)-(2-chloro-6-fluoro-phenyl)methyleneamino]-2-nitro-4-pyrrolidin-1-ylsulfonyl-aniline CAS Name: N-[(E)-(2-chloro-6-fluorophenyl)methylideneamino]-2-nitro-4-(1-pyrrolidinylsulfonyl)aniline IUPAC Name: N-[(E)-(2-chloro-6-fluorophenyl)methylideneamino]-2-nitro-4-pyrrolidin-1-ylsulfonylaniline Traditional Name: [(E)-(2-chloro-6-fluoro-benzylidene)amino]-(2-nitro-4-pyrrolidinosulfonyl-phenyl)amine Formula: C17H16ClFN4O4S MolecularWeight: 426.849743

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)NN=CC3=C(C=CC=C3Cl)F)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)N/N=C/C3=C(C=CC=C3Cl)F)[N+](=O)[O-]

InChI

InChI=1S/C17H16ClFN4O4S/c18-14-4-3-5-15(19)13(14)11-20-21-16-7-6-12(10-17(16)23(24)25)28(26,27)22-8-1-2-9-22/h3-7,10-11,21H,1-2,8-9H2/b20-11+