5-fluoranyl-2,2-dimethyl-8-nitro-4-(phenethylamino)-3,4-dihydrochromen-3-ol

Systemtic Name: 5-fluoranyl-2,2-dimethyl-8-nitro-4-(phenethylamino)-3,4-dihydrochromen-3-ol Openeye Name: 5-fluoro-2,2-dimethyl-8-nitro-4-(phenethylamino)chroman-3-ol CAS Name: 5-fluoro-2,2-dimethyl-8-nitro-4-(phenethylamino)-3,4-dihydro-2H-1-benzopyran-3-ol IUPAC Name: 5-fluoro-2,2-dimethyl-8-nitro-4-(phenethylamino)-3,4-dihydrochromen-3-ol Traditional Name: 5-fluoro-2,2-dimethyl-8-nitro-4-(phenethylamino)chroman-3-ol Formula: C19H21FN2O4 MolecularWeight: 360.379443

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C(C2=C(C=CC(=C2O1)[N+](=O)[O-])F)NCCC3=CC=CC=C3)O)C

Isomeric SMILES

CC1(C(C(C2=C(C=CC(=C2O1)[N+](=O)[O-])F)NCCC3=CC=CC=C3)O)C

InChI

InChI=1S/C19H21FN2O4/c1-19(2)18(23)16(21-11-10-12-6-4-3-5-7-12)15-13(20)8-9-14(22(24)25)17(15)26-19/h3-9,16,18,21,23H,10-11H2,1-2H3