5-(3-methyl-4-nitro-1,2-oxazol-5-yl)-4-(4-nitrophenyl)pentan-2-one

Systemtic Name: 5-(3-methyl-4-nitro-1,2-oxazol-5-yl)-4-(4-nitrophenyl)pentan-2-one Openeye Name: 5-(3-methyl-4-nitro-isoxazol-5-yl)-4-(4-nitrophenyl)pentan-2-one CAS Name: 5-(3-methyl-4-nitro-5-isoxazolyl)-4-(4-nitrophenyl)-2-pentanone IUPAC Name: 5-(3-methyl-4-nitro-1,2-oxazol-5-yl)-4-(4-nitrophenyl)pentan-2-one Traditional Name: 5-(3-methyl-4-nitro-isoxazol-5-yl)-4-(4-nitrophenyl)pentan-2-one Formula: C15H15N3O6 MolecularWeight: 333.2961

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=C1[N+](=O)[O-])CC(CC(=O)C)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC1=NOC(=C1[N+](=O)[O-])CC(CC(=O)C)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C15H15N3O6/c1-9(19)7-12(11-3-5-13(6-4-11)17(20)21)8-14-15(18(22)23)10(2)16-24-14/h3-6,12H,7-8H2,1-2H3