(3S)-4-(3,3-dimethyl-5-oxidanylidene-cyclopenten-1-yl)-3-methyl-butanal

Systemtic Name: (3S)-4-(3,3-dimethyl-5-oxidanylidene-cyclopenten-1-yl)-3-methyl-butanal Openeye Name: (3S)-4-(3,3-dimethyl-5-oxo-cyclopenten-1-yl)-3-methyl-butanal CAS Name: (3S)-4-(3,3-dimethyl-5-oxo-1-cyclopentenyl)-3-methylbutanal IUPAC Name: (3S)-4-(3,3-dimethyl-5-oxocyclopenten-1-yl)-3-methylbutanal Traditional Name: (3S)-4-(5-keto-3,3-dimethyl-cyclopenten-1-yl)-3-methyl-butyraldehyde Formula: C12H18O2 MolecularWeight: 194.27012

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC=O)CC1=CC(CC1=O)(C)C

Isomeric SMILES

C[C@H](CC=O)CC1=CC(CC1=O)(C)C

InChI

InChI=1S/C12H18O2/c1-9(4-5-13)6-10-7-12(2,3)8-11(10)14/h5,7,9H,4,6,8H2,1-3H3/t9-/m1/s1