5-(4-chloranyl-3-nitro-phenyl)-4,4-dimethyl-oxolan-2-one

Systemtic Name: 5-(4-chloranyl-3-nitro-phenyl)-4,4-dimethyl-oxolan-2-one Openeye Name: 5-(4-chloro-3-nitro-phenyl)-4,4-dimethyl-tetrahydrofuran-2-one CAS Name: 5-(4-chloro-3-nitrophenyl)-4,4-dimethyl-2-oxolanone IUPAC Name: 5-(4-chloro-3-nitrophenyl)-4,4-dimethyloxolan-2-one Traditional Name: 5-(4-chloro-3-nitro-phenyl)-4,4-dimethyl-tetrahydrofuran-2-one Formula: C12H12ClNO4 MolecularWeight: 269.68098

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=O)OC1C2=CC(=C(C=C2)Cl)[N+](=O)[O-])C

Isomeric SMILES

CC1(CC(=O)OC1C2=CC(=C(C=C2)Cl)[N+](=O)[O-])C

InChI

InChI=1S/C12H12ClNO4/c1-12(2)6-10(15)18-11(12)7-3-4-8(13)9(5-7)14(16)17/h3-5,11H,6H2,1-2H3