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

Systemtic Name: 2,2-dimethyl-7-nitro-4-(phenethylamino)-6-phenyl-3,4-dihydrochromen-3-ol Openeye Name: 2,2-dimethyl-7-nitro-4-(phenethylamino)-6-phenyl-chroman-3-ol CAS Name: 2,2-dimethyl-7-nitro-4-(phenethylamino)-6-phenyl-3,4-dihydro-2H-1-benzopyran-3-ol IUPAC Name: 2,2-dimethyl-7-nitro-4-(phenethylamino)-6-phenyl-3,4-dihydrochromen-3-ol Traditional Name: 2,2-dimethyl-7-nitro-4-(phenethylamino)-6-phenyl-chroman-3-ol Formula: C25H26N2O4 MolecularWeight: 418.48494

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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-])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-])NCCC4=CC=CC=C4)O)C

InChI

InChI=1S/C25H26N2O4/c1-25(2)24(28)23(26-14-13-17-9-5-3-6-10-17)20-15-19(18-11-7-4-8-12-18)21(27(29)30)16-22(20)31-25/h3-12,15-16,23-24,26,28H,13-14H2,1-2H3