3-(2-methyl-6-nitro-phenoxy)butan-2-one

Systemtic Name: 3-(2-methyl-6-nitro-phenoxy)butan-2-one Openeye Name: 3-(2-methyl-6-nitro-phenoxy)butan-2-one CAS Name: 3-(2-methyl-6-nitrophenoxy)-2-butanone IUPAC Name: 3-(2-methyl-6-nitrophenoxy)butan-2-one Traditional Name: 3-(2-methyl-6-nitro-phenoxy)butan-2-one Formula: C11H13NO4 MolecularWeight: 223.22522

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H13NO4/c1-7-5-4-6-10(12(14)15)11(7)16-9(3)8(2)13/h4-6,9H,1-3H3