4-[[(E)-3-(2-chloranyl-4-nitro-phenyl)prop-2-enoyl]amino]-2-methyl-benzenesulfonyl fluoride

Systemtic Name: 4-[[(E)-3-(2-chloranyl-4-nitro-phenyl)prop-2-enoyl]amino]-2-methyl-benzenesulfonyl fluoride Openeye Name: 4-[[(E)-3-(2-chloro-4-nitro-phenyl)prop-2-enoyl]amino]-2-methyl-benzenesulfonyl fluoride CAS Name: 4-[[(E)-3-(2-chloro-4-nitrophenyl)-1-oxoprop-2-enyl]amino]-2-methylbenzenesulfonyl fluoride IUPAC Name: 4-[[(E)-3-(2-chloro-4-nitrophenyl)prop-2-enoyl]amino]-2-methylbenzenesulfonyl fluoride Traditional Name: 4-[[(E)-3-(2-chloro-4-nitro-phenyl)acryloyl]amino]-2-methyl-benzenesulfonyl fluoride Formula: C16H12ClFN2O5S MolecularWeight: 398.793283

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=O)C=CC2=C(C=C(C=C2)[N+](=O)[O-])Cl)S(=O)(=O)F

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)/C=C/C2=C(C=C(C=C2)[N+](=O)[O-])Cl)S(=O)(=O)F

InChI

InChI=1S/C16H12ClFN2O5S/c1-10-8-12(4-6-15(10)26(18,24)25)19-16(21)7-3-11-2-5-13(20(22)23)9-14(11)17/h2-9H,1H3,(H,19,21)/b7-3+