6-[2,4-bis(fluoranyl)phenyl]sulfanyl-5-nitro-2,3-dihydroinden-1-one; ethene

Systemtic Name: 6-[2,4-bis(fluoranyl)phenyl]sulfanyl-5-nitro-2,3-dihydroinden-1-one; ethene Openeye Name: 6-(2,4-difluorophenyl)sulfanyl-5-nitro-indan-1-one; ethylene CAS Name: 6-[(2,4-difluorophenyl)thio]-5-nitro-2,3-dihydroinden-1-one; ethene IUPAC Name: 6-(2,4-difluorophenyl)sulfanyl-5-nitro-2,3-dihydroinden-1-one; ethene Traditional Name: 6-[(2,4-difluorophenyl)thio]-5-nitro-indan-1-one; ethylene Formula: C17H13F2NO3S MolecularWeight: 349.351826

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Descriptors Computed from Structure

Canonical SMILES:

C=C.C1CC(=O)C2=CC(=C(C=C21)[N+](=O)[O-])SC3=C(C=C(C=C3)F)F

Isomeric SMILES

C=C.C1CC(=O)C2=CC(=C(C=C21)[N+](=O)[O-])SC3=C(C=C(C=C3)F)F

InChI

InChI=1S/C15H9F2NO3S.C2H4/c16-9-2-4-14(11(17)6-9)22-15-7-10-8(1-3-13(10)19)5-12(15)18(20)21;1-2/h2,4-7H,1,3H2;1-2H2