2-methyl-2-[6-(3-nitrophenyl)-3-oxidanylidene-hexyl]cyclopentane-1,3-dione

Systemtic Name: 2-methyl-2-[6-(3-nitrophenyl)-3-oxidanylidene-hexyl]cyclopentane-1,3-dione Openeye Name: 2-methyl-2-[6-(3-nitrophenyl)-3-oxo-hexyl]cyclopentane-1,3-dione CAS Name: 2-methyl-2-[6-(3-nitrophenyl)-3-oxohexyl]cyclopentane-1,3-dione IUPAC Name: 2-methyl-2-[6-(3-nitrophenyl)-3-oxohexyl]cyclopentane-1,3-dione Traditional Name: 2-[3-keto-6-(3-nitrophenyl)hexyl]-2-methyl-cyclopentane-1,3-quinone Formula: C18H21NO5 MolecularWeight: 331.36304

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=O)CCC1=O)CCC(=O)CCCC2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CC1(C(=O)CCC1=O)CCC(=O)CCCC2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C18H21NO5/c1-18(16(21)8-9-17(18)22)11-10-15(20)7-3-5-13-4-2-6-14(12-13)19(23)24/h2,4,6,12H,3,5,7-11H2,1H3