2-(4-chloranyl-2-nitro-phenyl)carbonyl-4-propan-2-yl-cyclohexane-1,3-dione

Systemtic Name: 2-(4-chloranyl-2-nitro-phenyl)carbonyl-4-propan-2-yl-cyclohexane-1,3-dione Openeye Name: 2-(4-chloro-2-nitro-benzoyl)-4-isopropyl-cyclohexane-1,3-dione CAS Name: 2-[(4-chloro-2-nitrophenyl)-oxomethyl]-4-propan-2-ylcyclohexane-1,3-dione IUPAC Name: 2-(4-chloro-2-nitrobenzoyl)-4-propan-2-ylcyclohexane-1,3-dione Traditional Name: 2-(4-chloro-2-nitro-benzoyl)-4-isopropyl-cyclohexane-1,3-quinone Formula: C16H16ClNO5 MolecularWeight: 337.75494

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1CCC(=O)C(C1=O)C(=O)C2=C(C=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

CC(C)C1CCC(=O)C(C1=O)C(=O)C2=C(C=C(C=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C16H16ClNO5/c1-8(2)10-5-6-13(19)14(15(10)20)16(21)11-4-3-9(17)7-12(11)18(22)23/h3-4,7-8,10,14H,5-6H2,1-2H3