2-methyl-4-[(3-nitrophenyl)methyl]-4H-1,3-oxazol-5-one

Systemtic Name: 2-methyl-4-[(3-nitrophenyl)methyl]-4H-1,3-oxazol-5-one Openeye Name: 2-methyl-4-[(3-nitrophenyl)methyl]-4H-oxazol-5-one CAS Name: 2-methyl-4-[(3-nitrophenyl)methyl]-4H-oxazol-5-one IUPAC Name: 2-methyl-4-[(3-nitrophenyl)methyl]-4H-1,3-oxazol-5-one Traditional Name: 2-methyl-4-(3-nitrobenzyl)-2-oxazolin-5-one Formula: C11H10N2O4 MolecularWeight: 234.2081

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(C(=O)O1)CC2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CC1=NC(C(=O)O1)CC2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C11H10N2O4/c1-7-12-10(11(14)17-7)6-8-3-2-4-9(5-8)13(15)16/h2-5,10H,6H2,1H3