N-[4-[2-(4-fluorophenyl)ethylamino]-2,2-dimethyl-7-nitro-3-oxidanyl-3,4-dihydrochromen-6-yl]-2-methyl-propanamide

Systemtic Name: N-[4-[2-(4-fluorophenyl)ethylamino]-2,2-dimethyl-7-nitro-3-oxidanyl-3,4-dihydrochromen-6-yl]-2-methyl-propanamide Openeye Name: N-[4-[2-(4-fluorophenyl)ethylamino]-3-hydroxy-2,2-dimethyl-7-nitro-chroman-6-yl]-2-methyl-propanamide CAS Name: N-[4-[2-(4-fluorophenyl)ethylamino]-3-hydroxy-2,2-dimethyl-7-nitro-3,4-dihydro-2H-1-benzopyran-6-yl]-2-methylpropanamide IUPAC Name: N-[4-[2-(4-fluorophenyl)ethylamino]-3-hydroxy-2,2-dimethyl-7-nitro-3,4-dihydrochromen-6-yl]-2-methylpropanamide Traditional Name: N-[4-[2-(4-fluorophenyl)ethylamino]-3-hydroxy-2,2-dimethyl-7-nitro-chroman-6-yl]-2-methyl-propionamide Formula: C23H28FN3O5 MolecularWeight: 445.483923

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NC1=C(C=C2C(=C1)C(C(C(O2)(C)C)O)NCCC3=CC=C(C=C3)F)[N+](=O)[O-]

Isomeric SMILES

CC(C)C(=O)NC1=C(C=C2C(=C1)C(C(C(O2)(C)C)O)NCCC3=CC=C(C=C3)F)[N+](=O)[O-]

InChI

InChI=1S/C23H28FN3O5/c1-13(2)22(29)26-17-11-16-19(12-18(17)27(30)31)32-23(3,4)21(28)20(16)25-10-9-14-5-7-15(24)8-6-14/h5-8,11-13,20-21,25,28H,9-10H2,1-4H3,(H,26,29)