5,5-dimethyl-2-[1-[[(2S)-1-oxidanylbutan-2-yl]amino]propylidene]cyclohexane-1,3-dione

Systemtic Name: 5,5-dimethyl-2-[1-[[(2S)-1-oxidanylbutan-2-yl]amino]propylidene]cyclohexane-1,3-dione Openeye Name: 2-[1-[[(1S)-1-(hydroxymethyl)propyl]amino]propylidene]-5,5-dimethyl-cyclohexane-1,3-dione CAS Name: 2-[1-[[(2S)-1-hydroxybutan-2-yl]amino]propylidene]-5,5-dimethylcyclohexane-1,3-dione IUPAC Name: 2-[1-[[(2S)-1-hydroxybutan-2-yl]amino]propylidene]-5,5-dimethylcyclohexane-1,3-dione Traditional Name: 5,5-dimethyl-2-[1-[[(1S)-1-methylolpropyl]amino]propylidene]cyclohexane-1,3-quinone Formula: C15H25NO3 MolecularWeight: 267.3639

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CO)NC(=C1C(=O)CC(CC1=O)(C)C)CC

Isomeric SMILES

CC[C@@H](CO)NC(=C1C(=O)CC(CC1=O)(C)C)CC

InChI

InChI=1S/C15H25NO3/c1-5-10(9-17)16-11(6-2)14-12(18)7-15(3,4)8-13(14)19/h10,16-17H,5-9H2,1-4H3/t10-/m0/s1