2,2-dimethyl-7-nitro-4-(phenethylamino)-3,4-dihydrochromen-3-ol

Systemtic Name: 2,2-dimethyl-7-nitro-4-(phenethylamino)-3,4-dihydrochromen-3-ol Openeye Name: 2,2-dimethyl-7-nitro-4-(phenethylamino)chroman-3-ol CAS Name: 2,2-dimethyl-7-nitro-4-(phenethylamino)-3,4-dihydro-2H-1-benzopyran-3-ol IUPAC Name: 2,2-dimethyl-7-nitro-4-(phenethylamino)-3,4-dihydrochromen-3-ol Traditional Name: 2,2-dimethyl-7-nitro-4-(phenethylamino)chroman-3-ol Formula: C19H22N2O4 MolecularWeight: 342.38898

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C(C2=C(O1)C=C(C=C2)[N+](=O)[O-])NCCC3=CC=CC=C3)O)C

Isomeric SMILES

CC1(C(C(C2=C(O1)C=C(C=C2)[N+](=O)[O-])NCCC3=CC=CC=C3)O)C

InChI

InChI=1S/C19H22N2O4/c1-19(2)18(22)17(20-11-10-13-6-4-3-5-7-13)15-9-8-14(21(23)24)12-16(15)25-19/h3-9,12,17-18,20,22H,10-11H2,1-2H3