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

Systemtic Name: N-[2,2-dimethyl-7-nitro-3-oxidanyl-4-(phenethylamino)-3,4-dihydrochromen-6-yl]-2,2-dimethyl-propanamide Openeye Name: N-[3-hydroxy-2,2-dimethyl-7-nitro-4-(phenethylamino)chroman-6-yl]-2,2-dimethyl-propanamide CAS Name: N-[3-hydroxy-2,2-dimethyl-7-nitro-4-(phenethylamino)-3,4-dihydro-2H-1-benzopyran-6-yl]-2,2-dimethylpropanamide IUPAC Name: N-[3-hydroxy-2,2-dimethyl-7-nitro-4-(phenethylamino)-3,4-dihydrochromen-6-yl]-2,2-dimethylpropanamide Traditional Name: N-[3-hydroxy-2,2-dimethyl-7-nitro-4-(phenethylamino)chroman-6-yl]-2,2-dimethyl-propionamide Formula: C24H31N3O5 MolecularWeight: 441.52004

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H31N3O5/c1-23(2,3)22(29)26-17-13-16-19(14-18(17)27(30)31)32-24(4,5)21(28)20(16)25-12-11-15-9-7-6-8-10-15/h6-10,13-14,20-21,25,28H,11-12H2,1-5H3,(H,26,29)