4,4-dimethyl-6-(3-nitrophenyl)-1H-3,1-benzoxazin-2-one

Systemtic Name: 4,4-dimethyl-6-(3-nitrophenyl)-1H-3,1-benzoxazin-2-one Openeye Name: 4,4-dimethyl-6-(3-nitrophenyl)-1H-3,1-benzoxazin-2-one CAS Name: 4,4-dimethyl-6-(3-nitrophenyl)-1H-3,1-benzoxazin-2-one IUPAC Name: 4,4-dimethyl-6-(3-nitrophenyl)-1H-3,1-benzoxazin-2-one Traditional Name: 4,4-dimethyl-6-(3-nitrophenyl)-1H-3,1-benzoxazin-2-one Formula: C16H14N2O4 MolecularWeight: 298.29336

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H14N2O4/c1-16(2)13-9-11(6-7-14(13)17-15(19)22-16)10-4-3-5-12(8-10)18(20)21/h3-9H,1-2H3,(H,17,19)