1-chloranyl-3,3-dimethyl-1-(4-nitrophenoxy)butan-2-one

Systemtic Name: 1-chloranyl-3,3-dimethyl-1-(4-nitrophenoxy)butan-2-one Openeye Name: 1-chloro-3,3-dimethyl-1-(4-nitrophenoxy)butan-2-one CAS Name: 1-chloro-3,3-dimethyl-1-(4-nitrophenoxy)-2-butanone IUPAC Name: 1-chloro-3,3-dimethyl-1-(4-nitrophenoxy)butan-2-one Traditional Name: 1-chloro-3,3-dimethyl-1-(4-nitrophenoxy)butan-2-one Formula: C12H14ClNO4 MolecularWeight: 271.69686

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)C(OC1=CC=C(C=C1)[N+](=O)[O-])Cl

Isomeric SMILES

CC(C)(C)C(=O)C(OC1=CC=C(C=C1)[N+](=O)[O-])Cl

InChI

InChI=1S/C12H14ClNO4/c1-12(2,3)10(15)11(13)18-9-6-4-8(5-7-9)14(16)17/h4-7,11H,1-3H3