2,2-dimethyl-7-nitro-6-(3-nitrophenyl)-4-(phenethylamino)-3,4-dihydrochromen-3-ol

Systemtic Name: 2,2-dimethyl-7-nitro-6-(3-nitrophenyl)-4-(phenethylamino)-3,4-dihydrochromen-3-ol Openeye Name: 2,2-dimethyl-7-nitro-6-(3-nitrophenyl)-4-(phenethylamino)chroman-3-ol CAS Name: 2,2-dimethyl-7-nitro-6-(3-nitrophenyl)-4-(phenethylamino)-3,4-dihydro-2H-1-benzopyran-3-ol IUPAC Name: 2,2-dimethyl-7-nitro-6-(3-nitrophenyl)-4-(phenethylamino)-3,4-dihydrochromen-3-ol Traditional Name: 2,2-dimethyl-7-nitro-6-(3-nitrophenyl)-4-(phenethylamino)chroman-3-ol Formula: C25H25N3O6 MolecularWeight: 463.4825

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C(C2=C(O1)C=C(C(=C2)C3=CC(=CC=C3)[N+](=O)[O-])[N+](=O)[O-])NCCC4=CC=CC=C4)O)C

Isomeric SMILES

CC1(C(C(C2=C(O1)C=C(C(=C2)C3=CC(=CC=C3)[N+](=O)[O-])[N+](=O)[O-])NCCC4=CC=CC=C4)O)C

InChI

InChI=1S/C25H25N3O6/c1-25(2)24(29)23(26-12-11-16-7-4-3-5-8-16)20-14-19(21(28(32)33)15-22(20)34-25)17-9-6-10-18(13-17)27(30)31/h3-10,13-15,23-24,26,29H,11-12H2,1-2H3