5,5-dimethyl-2-[1-oxidanyl-3-(phenylmethyl)imino-propylidene]cyclohexane-1,3-dione

Systemtic Name: 5,5-dimethyl-2-[1-oxidanyl-3-(phenylmethyl)imino-propylidene]cyclohexane-1,3-dione Openeye Name: 2-(3-benzylimino-1-hydroxy-propylidene)-5,5-dimethyl-cyclohexane-1,3-dione CAS Name: 2-[1-hydroxy-3-(phenylmethyl)iminopropylidene]-5,5-dimethylcyclohexane-1,3-dione IUPAC Name: 2-(3-benzylimino-1-hydroxypropylidene)-5,5-dimethylcyclohexane-1,3-dione Traditional Name: 2-(3-benzylimino-1-hydroxy-propylidene)-5,5-dimethyl-cyclohexane-1,3-quinone Formula: C18H21NO3 MolecularWeight: 299.36424

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=O)C(=C(CC=NCC2=CC=CC=C2)O)C(=O)C1)C

Isomeric SMILES

CC1(CC(=O)C(=C(CC=NCC2=CC=CC=C2)O)C(=O)C1)C

InChI

InChI=1S/C18H21NO3/c1-18(2)10-15(21)17(16(22)11-18)14(20)8-9-19-12-13-6-4-3-5-7-13/h3-7,9,20H,8,10-12H2,1-2H3