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

Systemtic Name: 4,4-diethyl-6-(3-nitrophenyl)-1H-3,1-benzoxazin-2-one Openeye Name: 4,4-diethyl-6-(3-nitrophenyl)-1H-3,1-benzoxazin-2-one CAS Name: 4,4-diethyl-6-(3-nitrophenyl)-1H-3,1-benzoxazin-2-one IUPAC Name: 4,4-diethyl-6-(3-nitrophenyl)-1H-3,1-benzoxazin-2-one Traditional Name: 4,4-diethyl-6-(3-nitrophenyl)-1H-3,1-benzoxazin-2-one Formula: C18H18N2O4 MolecularWeight: 326.34652

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(C2=C(C=CC(=C2)C3=CC(=CC=C3)[N+](=O)[O-])NC(=O)O1)CC

Isomeric SMILES

CCC1(C2=C(C=CC(=C2)C3=CC(=CC=C3)[N+](=O)[O-])NC(=O)O1)CC

InChI

InChI=1S/C18H18N2O4/c1-3-18(4-2)15-11-13(8-9-16(15)19-17(21)24-18)12-6-5-7-14(10-12)20(22)23/h5-11H,3-4H2,1-2H3,(H,19,21)