2-(2,2-dimethyl-6-nitro-1,4-benzoxazin-3-yl)-1-phenyl-ethanol

Systemtic Name: 2-(2,2-dimethyl-6-nitro-1,4-benzoxazin-3-yl)-1-phenyl-ethanol Openeye Name: 2-(2,2-dimethyl-6-nitro-1,4-benzoxazin-3-yl)-1-phenyl-ethanol CAS Name: 2-(2,2-dimethyl-6-nitro-1,4-benzoxazin-3-yl)-1-phenylethanol IUPAC Name: 2-(2,2-dimethyl-6-nitro-1,4-benzoxazin-3-yl)-1-phenylethanol Traditional Name: 2-(2,2-dimethyl-6-nitro-1,4-benzoxazin-3-yl)-1-phenyl-ethanol Formula: C18H18N2O4 MolecularWeight: 326.34652

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=NC2=C(O1)C=CC(=C2)[N+](=O)[O-])CC(C3=CC=CC=C3)O)C

Isomeric SMILES

CC1(C(=NC2=C(O1)C=CC(=C2)[N+](=O)[O-])CC(C3=CC=CC=C3)O)C

InChI

InChI=1S/C18H18N2O4/c1-18(2)17(11-15(21)12-6-4-3-5-7-12)19-14-10-13(20(22)23)8-9-16(14)24-18/h3-10,15,21H,11H2,1-2H3