2-[(2R)-4,4-diphenyl-1,2-dihydro-3,1-benzoxazin-2-yl]-4-nitro-phenolate

Systemtic Name: 2-[(2R)-4,4-diphenyl-1,2-dihydro-3,1-benzoxazin-2-yl]-4-nitro-phenolate Openeye Name: 2-[(2R)-4,4-diphenyl-1,2-dihydro-3,1-benzoxazin-2-yl]-4-nitro-phenolate CAS Name: 2-[(2R)-4,4-diphenyl-1,2-dihydro-3,1-benzoxazin-2-yl]-4-nitrophenolate IUPAC Name: 2-[(2R)-4,4-diphenyl-1,2-dihydro-3,1-benzoxazin-2-yl]-4-nitrophenolate Traditional Name: 2-[(2R)-4,4-diphenyl-1,2-dihydro-3,1-benzoxazin-2-yl]-4-nitro-phenolate Formula: C26H19N2O4- MolecularWeight: 423.44006

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2(C3=CC=CC=C3NC(O2)C4=C(C=CC(=C4)[N+](=O)[O-])[O-])C5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)C2(C3=CC=CC=C3N[C@H](O2)C4=C(C=CC(=C4)[N+](=O)[O-])[O-])C5=CC=CC=C5

InChI

InChI=1S/C26H20N2O4/c29-24-16-15-20(28(30)31)17-21(24)25-27-23-14-8-7-13-22(23)26(32-25,18-9-3-1-4-10-18)19-11-5-2-6-12-19/h1-17,25,27,29H/p-1/t25-/m1/s1