2-[2,2-bis(fluoranylmethyl)-6-nitro-3-oxidanyl-3,4-dihydrochromen-4-yl]-3H-isoindol-1-one

Systemtic Name: 2-[2,2-bis(fluoranylmethyl)-6-nitro-3-oxidanyl-3,4-dihydrochromen-4-yl]-3H-isoindol-1-one Openeye Name: 2-[2,2-bis(fluoromethyl)-3-hydroxy-6-nitro-chroman-4-yl]isoindolin-1-one CAS Name: 2-[2,2-bis(fluoromethyl)-3-hydroxy-6-nitro-3,4-dihydro-2H-1-benzopyran-4-yl]-3H-isoindol-1-one IUPAC Name: 2-[2,2-bis(fluoromethyl)-3-hydroxy-6-nitro-3,4-dihydrochromen-4-yl]-3H-isoindol-1-one Traditional Name: 2-[2,2-bis(fluoromethyl)-3-hydroxy-6-nitro-chroman-4-yl]isoindolin-1-one Formula: C19H16F2N2O5 MolecularWeight: 390.337546

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC=CC=C2C(=O)N1C3C(C(OC4=C3C=C(C=C4)[N+](=O)[O-])(CF)CF)O

Isomeric SMILES

C1C2=CC=CC=C2C(=O)N1C3C(C(OC4=C3C=C(C=C4)[N+](=O)[O-])(CF)CF)O

InChI

InChI=1S/C19H16F2N2O5/c20-9-19(10-21)17(24)16(14-7-12(23(26)27)5-6-15(14)28-19)22-8-11-3-1-2-4-13(11)18(22)25/h1-7,16-17,24H,8-10H2